3-[cyclohexyl(methyl)amino]-1-(4-ethoxyphenyl)-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione

Systemtic Name: 3-[cyclohexyl(methyl)amino]-1-(4-ethoxyphenyl)-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 3-[cyclohexyl(methyl)amino]-1-(4-ethoxyphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-[cyclohexyl(methyl)amino]-1-(4-ethoxyphenyl)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 3-[cyclohexyl(methyl)amino]-1-(4-ethoxyphenyl)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 3-[cyclohexyl(methyl)amino]-1-p-phenetyl-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C26H30N2O3S MolecularWeight: 450.593

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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)C)N(C)C4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)N(C)C4CCCCC4

InChI

InChI=1S/C26H30N2O3S/c1-4-31-21-14-12-20(13-15-21)28-25(29)23(27(3)19-8-6-5-7-9-19)24(26(28)30)32-22-16-10-18(2)11-17-22/h10-17,19H,4-9H2,1-3H3