3-[(5-chloranyl-2-methoxy-phenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(5-chloro-2-methoxy-anilino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(5-chloro-2-methoxyanilino)-4-[(4-methylphenyl)thio]-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(5-chloro-2-methoxyanilino)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-benzyl-3-(5-chloro-2-methoxy-anilino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)NC4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)NC4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C25H21ClN2O3S/c1-16-8-11-19(12-9-16)32-23-22(27-20-14-18(26)10-13-21(20)31-2)24(29)28(25(23)30)15-17-6-4-3-5-7-17/h3-14,27H,15H2,1-2H3