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

Systemtic Name: 3-(cyclohexylamino)-1-(2-ethoxyphenyl)-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 3-(cyclohexylamino)-1-(2-ethoxyphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(cyclohexylamino)-1-(2-ethoxyphenyl)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 3-(cyclohexylamino)-1-(2-ethoxyphenyl)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 3-(cyclohexylamino)-1-o-phenetyl-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NC4CCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NC4CCCCC4

InChI

InChI=1S/C25H28N2O3S/c1-3-30-21-12-8-7-11-20(21)27-24(28)22(26-18-9-5-4-6-10-18)23(25(27)29)31-19-15-13-17(2)14-16-19/h7-8,11-16,18,26H,3-6,9-10H2,1-2H3