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

Systemtic Name: 5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]-1-(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]-1-(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H24N4O2S MolecularWeight: 432.53796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4C

Isomeric SMILES

CCC(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4C

InChI

InChI=1S/C24H24N4O2S/c1-3-17(12-16-13-26-20-10-6-5-9-18(16)20)25-14-19-22(29)27-24(31)28(23(19)30)21-11-7-4-8-15(21)2/h4-11,13-14,17,25-26H,3,12H2,1-2H3,(H,27,29,31)