Name: Name:tert-butyl 3-carbamothioyl-3-acetamidopyrrolidine-1-carboxylate
Brand: Angene
SKU: AG01BB3D
Rating: 90 (10 reviews)

tert-butyl 3-carbamothioyl-3-acetamidopyrrolidine-1-carboxylate

CAS No.:

1803589-62-9

Catalog Number:

AG01BB3D

Molecular Formula:

C12H21N3O3S

Molecular Weight:

287.3784

Catalog Number:

AG01BB3D

Chemical Name:

tert-butyl 3-carbamothioyl-3-acetamidopyrrolidine-1-carboxylate

CAS Number:

1803589-62-9

Molecular Formula:

C12H21N3O3S

Molecular Weight:

287.3784

MDL Number:

MFCD28714554

IUPAC Name:

tert-butyl 3-acetamido-3-carbamothioylpyrrolidine-1-carboxylate

InChI:

InChI=1S/C12H21N3O3S/c1-8(16)14-12(9(13)19)5-6-15(7-12)10(17)18-11(2,3)4/h5-7H2,1-4H3,(H2,13,19)(H,14,16)

InChI Key:

FIUPXWQOEMBFJJ-UHFFFAOYSA-N

SMILES:

CC(=O)NC1(CCN(C1)C(=O)OC(C)(C)C)C(=S)N

Complexity:

406

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

287.13g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

287.378g/mol

Monoisotopic Mass:

287.13g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

117A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: