2-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-butan-2-ylphenyl)propanamide

Systemtic Name: 2-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-butan-2-ylphenyl)propanamide Openeye Name: 2-[[5-(2-amino-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-sec-butylphenyl)propanamide CAS Name: 2-[[5-[(2-amino-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]thio]-N-(2-butan-2-ylphenyl)propanamide IUPAC Name: 2-[[5-(2-amino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-butan-2-ylphenyl)propanamide Traditional Name: 2-[[5-[(2-amino-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]thio]-N-(2-sec-butylphenyl)propionamide Formula: C17H22N4O2S3 MolecularWeight: 410.57718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NN=C(S2)SCC(=O)N

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)SC2=NN=C(S2)SCC(=O)N

InChI

InChI=1S/C17H22N4O2S3/c1-4-10(2)12-7-5-6-8-13(12)19-15(23)11(3)25-17-21-20-16(26-17)24-9-14(18)22/h5-8,10-11H,4,9H2,1-3H3,(H2,18,22)(H,19,23)