[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] (3R)-3-methylpiperidine-1-carbodithioate

Systemtic Name: [2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] (3R)-3-methylpiperidine-1-carbodithioate Openeye Name: [2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl] (3R)-3-methylpiperidine-1-carbodithioate CAS Name: (3R)-3-methyl-1-piperidinecarbodithioic acid [2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl] (3R)-3-methylpiperidine-1-carbodithioate Traditional Name: (3R)-3-methylpiperidine-1-carbodithioic acid [2-keto-2-[4-(4-nitrophenyl)piperazino]ethyl] ester Formula: C19H26N4O3S2 MolecularWeight: 422.56474

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=S)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=S)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H26N4O3S2/c1-15-3-2-8-22(13-15)19(27)28-14-18(24)21-11-9-20(10-12-21)16-4-6-17(7-5-16)23(25)26/h4-7,15H,2-3,8-14H2,1H3/t15-/m1/s1