[1-[(4-cyanophenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate

Systemtic Name: [1-[(4-cyanophenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl] pyrrolidine-1-carbodithioate Openeye Name: [2-[(4-cyanophenyl)carbamoylamino]-1-methyl-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-[[(4-cyanoanilino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-cyanophenyl)carbamoylamino]-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-[(4-cyanophenyl)carbamoylamino]-2-keto-1-methyl-ethyl] ester Formula: C16H18N4O2S2 MolecularWeight: 362.46972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=C(C=C1)C#N)SC(=S)N2CCCC2

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=C(C=C1)C#N)SC(=S)N2CCCC2

InChI

InChI=1S/C16H18N4O2S2/c1-11(24-16(23)20-8-2-3-9-20)14(21)19-15(22)18-13-6-4-12(10-17)5-7-13/h4-7,11H,2-3,8-9H2,1H3,(H2,18,19,21,22)