[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] N-phenyl-N-(phenylmethyl)carbamodithioate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] N-phenyl-N-(phenylmethyl)carbamodithioate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] N-benzyl-N-phenyl-carbamodithioate CAS Name: N-phenyl-N-(phenylmethyl)carbamodithioic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] N-benzyl-N-phenylcarbamodithioate Traditional Name: N-benzyl-N-phenyl-carbamodithioic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C23H19N3OS2 MolecularWeight: 417.54646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=S)SCC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=S)SCC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C23H19N3OS2/c24-15-19-10-7-11-20(14-19)25-22(27)17-29-23(28)26(21-12-5-2-6-13-21)16-18-8-3-1-4-9-18/h1-14H,16-17H2,(H,25,27)