4-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[5-(2-amino-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[5-[(2-amino-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[5-(2-amino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[[5-[(2-amino-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]thio]methyl]-N-phenyl-benzamide Formula: C18H16N4O2S3 MolecularWeight: 416.54024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(S3)SCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(S3)SCC(=O)N

InChI

InChI=1S/C18H16N4O2S3/c19-15(23)11-26-18-22-21-17(27-18)25-10-12-6-8-13(9-7-12)16(24)20-14-4-2-1-3-5-14/h1-9H,10-11H2,(H2,19,23)(H,20,24)