3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-[(2-methoxy-5-methyl-phenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-[(2-methoxy-5-methyl-phenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(2-methoxy-5-methyl-anilino)pyrrole-2,5-dione CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-4-(2-methoxy-5-methylanilino)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(2-methoxy-5-methylanilino)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-[(4,6-dimethylpyrimidin-2-yl)thio]-4-(2-methoxy-5-methyl-anilino)-3-pyrroline-2,5-quinone Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=NC(=CC(=N4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C25H24N4O3S/c1-15-10-11-20(32-4)19(12-15)28-21-22(33-25-26-16(2)13-17(3)27-25)24(31)29(23(21)30)14-18-8-6-5-7-9-18/h5-13,28H,14H2,1-4H3