3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2,5-dimethylphenyl)pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2,5-dimethylphenyl)pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2,5-dimethylphenyl)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-(2,5-dimethylphenyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2,5-dimethylphenyl)pyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-(2,5-dimethylphenyl)-3-pyrroline-2,5-quinone Formula: C24H25ClN2O2S MolecularWeight: 440.9855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN2O2S/c1-15-8-9-16(2)20(14-15)27-23(28)21(26-18-6-4-3-5-7-18)22(24(27)29)30-19-12-10-17(25)11-13-19/h8-14,18,26H,3-7H2,1-2H3