5-[[2-methyl-1-[(2-methylphenyl)methyl]indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[2-methyl-1-[(2-methylphenyl)methyl]indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2-methyl-1-(o-tolylmethyl)indol-3-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-methyl-1-[(2-methylphenyl)methyl]-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[2-methyl-1-[(2-methylphenyl)methyl]indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[2-methyl-1-(2-methylbenzyl)indol-3-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)NC4=O)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)NC4=O)C

InChI

InChI=1S/C22H19N3O2S/c1-13-7-3-4-8-15(13)12-25-14(2)17(16-9-5-6-10-19(16)25)11-18-20(26)23-22(28)24-21(18)27/h3-11H,12H2,1-2H3,(H2,23,24,26,27,28)