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

Systemtic Name: 1-methyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-isobutylindol-3-yl)methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-methyl-5-[[1-(2-methylpropyl)-3-indolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-methyl-5-[[1-(2-methylpropyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-isobutylindol-3-yl)methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C

Isomeric SMILES

CC(C)CN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C

InChI

InChI=1S/C18H19N3O2S/c1-11(2)9-21-10-12(13-6-4-5-7-15(13)21)8-14-16(22)19-18(24)20(3)17(14)23/h4-8,10-11H,9H2,1-3H3,(H,19,22,24)