(5Z)-5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(2,3-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-5-[(1-cyclopentyl-2,5-dimethyl-3-pyrrolyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-5-[(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-5-[(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(2,3-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4CCCC4)C)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)/C(=C\C3=C(N(C(=C3)C)C4CCCC4)C)/C(=O)NC2=S)C

InChI

InChI=1S/C24H27N3O2S/c1-14-8-7-11-21(16(14)3)27-23(29)20(22(28)25-24(27)30)13-18-12-15(2)26(17(18)4)19-9-5-6-10-19/h7-8,11-13,19H,5-6,9-10H2,1-4H3,(H,25,28,30)/b20-13-