5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-benzyl-5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(1-cyclopentyl-2,5-dimethyl-3-pyrrolyl)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-benzyl-5-[(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-benzyl-5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylene]barbituric acid Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCC2)C)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2CCCC2)C)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-15-12-18(16(2)26(15)19-10-6-7-11-19)13-20-21(27)24-23(29)25(22(20)28)14-17-8-4-3-5-9-17/h3-5,8-9,12-13,19H,6-7,10-11,14H2,1-2H3,(H,24,27,29)