3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(4-methylpiperidin-1-yl)-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(4-methylpiperidin-1-yl)-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(4-methyl-1-piperidyl)pyrrole-2,5-dione CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-4-(4-methyl-1-piperidinyl)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-(4-methylpiperidin-1-yl)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-[(4,6-dimethylpyrimidin-2-yl)thio]-4-(4-methylpiperidino)-3-pyrroline-2,5-quinone Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=NC(=CC(=N4)C)C

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C23H26N4O2S/c1-15-9-11-26(12-10-15)19-20(30-23-24-16(2)13-17(3)25-23)22(29)27(21(19)28)14-18-7-5-4-6-8-18/h4-8,13,15H,9-12,14H2,1-3H3