Name: Name:5-(Sec-butylamino)-1,3,4-thiadiazole-2-thiol
Brand: Angene
SKU: AG00IEDW
Rating: 90 (10 reviews)

5-(Sec-butylamino)-1,3,4-thiadiazole-2-thiol

CAS No.:

871497-69-7

Catalog Number:

AG00IEDW

Molecular Formula:

C6H11N3S2

Molecular Weight:

189.3016

Catalog Number:

AG00IEDW

Chemical Name:

5-(Sec-butylamino)-1,3,4-thiadiazole-2-thiol

CAS Number:

871497-69-7

Molecular Formula:

C6H11N3S2

Molecular Weight:

189.3016

MDL Number:

MFCD07366428

IUPAC Name:

5-(butan-2-ylamino)-3H-1,3,4-thiadiazole-2-thione

InChI:

InChI=1S/C6H11N3S2/c1-3-4(2)7-5-8-9-6(10)11-5/h4H,3H2,1-2H3,(H,7,8)(H,9,10)

InChI Key:

MWKXOVRSXKLPFR-UHFFFAOYSA-N

SMILES:

CC(Nc1nnc(s1)S)CC

Complexity:

190

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.039g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

189.295g/mol

Monoisotopic Mass:

189.039g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1