3-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: 3-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-3-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: 3-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: N-(benzylcarbamoyl)-3-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: N-(benzylcarbamoyl)-3-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C17H22N4O2S3 MolecularWeight: 410.57718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)SCCC(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCCSC1=NN=C(S1)SCCC(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H22N4O2S3/c1-2-3-10-24-16-20-21-17(26-16)25-11-9-14(22)19-15(23)18-12-13-7-5-4-6-8-13/h4-8H,2-3,9-12H2,1H3,(H2,18,19,22,23)