[(1S)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [(1S)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] pyrrolidine-1-carbodithioate Openeye Name: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenyl-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [(1S)-2-keto-2-(m-anisidino)-1-phenyl-ethyl] ester Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC(=S)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)SC(=S)N3CCCC3

InChI

InChI=1S/C20H22N2O2S2/c1-24-17-11-7-10-16(14-17)21-19(23)18(15-8-3-2-4-9-15)26-20(25)22-12-5-6-13-22/h2-4,7-11,14,18H,5-6,12-13H2,1H3,(H,21,23)/t18-/m0/s1