1-(3-chloranyl-4-methyl-phenyl)-3-(cyclohexylamino)-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-(cyclohexylamino)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(cyclohexylamino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-methylphenyl)-3-(cyclohexylamino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(cyclohexylamino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(cyclohexylamino)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C23H23ClN2O2S MolecularWeight: 426.95892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4CCCCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4CCCCC4)Cl

InChI

InChI=1S/C23H23ClN2O2S/c1-15-12-13-17(14-19(15)24)26-22(27)20(25-16-8-4-2-5-9-16)21(23(26)28)29-18-10-6-3-7-11-18/h3,6-7,10-14,16,25H,2,4-5,8-9H2,1H3