1-(5-chloranyl-2-methoxy-phenyl)-3-(4-methylphenyl)sulfanyl-4-piperidin-1-yl-pyrrole-2,5-dione

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(4-methylphenyl)sulfanyl-4-piperidin-1-yl-pyrrole-2,5-dione Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(1-piperidyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[(4-methylphenyl)thio]-4-(1-piperidinyl)pyrrole-2,5-dione IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(4-methylphenyl)sulfanyl-4-piperidin-1-ylpyrrole-2,5-dione Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-piperidino-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C23H23ClN2O3S MolecularWeight: 442.95832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)N4CCCCC4

InChI

InChI=1S/C23H23ClN2O3S/c1-15-6-9-17(10-7-15)30-21-20(25-12-4-3-5-13-25)22(27)26(23(21)28)18-14-16(24)8-11-19(18)29-2/h6-11,14H,3-5,12-13H2,1-2H3