N-[(2-methoxyphenyl)methyl]-4-[5-(phenylmethylsulfanyl)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]benzamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-[5-(phenylmethylsulfanyl)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]benzamide Openeye Name: 4-(5-benzylsulfanyl-2-thioxo-1,3,4-thiadiazol-3-yl)-N-[(2-methoxyphenyl)methyl]benzamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-[5-(phenylmethylthio)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]benzamide IUPAC Name: 4-(5-benzylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)-N-[(2-methoxyphenyl)methyl]benzamide Traditional Name: 4-[5-(benzylthio)-2-thioxo-1,3,4-thiadiazol-3-yl]-N-o-anisyl-benzamide Formula: C24H21N3O2S3 MolecularWeight: 479.63744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3C(=S)SC(=N3)SCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3C(=S)SC(=N3)SCC4=CC=CC=C4

InChI

InChI=1S/C24H21N3O2S3/c1-29-21-10-6-5-9-19(21)15-25-22(28)18-11-13-20(14-12-18)27-24(30)32-23(26-27)31-16-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,25,28)