3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-[(4-methoxyphenyl)amino]-1-phenethyl-pyrrole-2,5-dione

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-[(4-methoxyphenyl)amino]-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(4-methoxyanilino)-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-4-(4-methoxyanilino)-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(4-methoxyanilino)-1-phenethylpyrrole-2,5-dione Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]-4-(p-anisidino)-1-phenethyl-3-pyrroline-2,5-quinone Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)NC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)NC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H24N4O3S/c1-16-15-17(2)27-25(26-16)33-22-21(28-19-9-11-20(32-3)12-10-19)23(30)29(24(22)31)14-13-18-7-5-4-6-8-18/h4-12,15,28H,13-14H2,1-3H3