(5E)-1-(3-methylphenyl)-5-[[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-(3-methylphenyl)-5-[[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-(m-tolyl)-5-[[1-(2-oxo-2-pyrrolidin-1-yl-ethyl)indol-3-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-(3-methylphenyl)-5-[[1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-(3-methylphenyl)-5-[[1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-[[1-(2-keto-2-pyrrolidino-ethyl)indol-3-yl]methylene]-1-(m-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)N5CCCC5)C(=O)NC2=S

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC(=O)N5CCCC5)/C(=O)NC2=S

InChI

InChI=1S/C26H24N4O3S/c1-17-7-6-8-19(13-17)30-25(33)21(24(32)27-26(30)34)14-18-15-29(22-10-3-2-9-20(18)22)16-23(31)28-11-4-5-12-28/h2-3,6-10,13-15H,4-5,11-12,16H2,1H3,(H,27,32,34)/b21-14+