[2-[(3-methylsulfanylphenyl)-phenyl-amino]-2-oxidanylidene-ethyl] 4-(phenylmethyl)piperidine-1-carbodithioate

Systemtic Name: [2-[(3-methylsulfanylphenyl)-phenyl-amino]-2-oxidanylidene-ethyl] 4-(phenylmethyl)piperidine-1-carbodithioate Openeye Name: [2-(N-(3-methylsulfanylphenyl)anilino)-2-oxo-ethyl] 4-benzylpiperidine-1-carbodithioate CAS Name: 4-(phenylmethyl)-1-piperidinecarbodithioic acid [2-(N-[3-(methylthio)phenyl]anilino)-2-oxoethyl] ester IUPAC Name: [2-(N-(3-methylsulfanylphenyl)anilino)-2-oxoethyl] 4-benzylpiperidine-1-carbodithioate Traditional Name: 4-benzylpiperidine-1-carbodithioic acid [2-keto-2-(N-[3-(methylthio)phenyl]anilino)ethyl] ester Formula: C28H30N2OS3 MolecularWeight: 506.7456

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N(C2=CC=CC=C2)C(=O)CSC(=S)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC(=C1)N(C2=CC=CC=C2)C(=O)CSC(=S)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H30N2OS3/c1-33-26-14-8-13-25(20-26)30(24-11-6-3-7-12-24)27(31)21-34-28(32)29-17-15-23(16-18-29)19-22-9-4-2-5-10-22/h2-14,20,23H,15-19,21H2,1H3