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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(4-ethoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(4-ethoxyphenyl)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-(4-ethoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(4-ethoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-p-phenetyl-3-pyrroline-2,5-quinone Formula: C24H25ClN2O3S MolecularWeight: 456.9849

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)NC4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)NC4CCCCC4

InChI

InChI=1S/C24H25ClN2O3S/c1-2-30-19-12-10-18(11-13-19)27-23(28)21(26-17-6-4-3-5-7-17)22(24(27)29)31-20-14-8-16(25)9-15-20/h8-15,17,26H,2-7H2,1H3