1-cyclohexyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-cyclohexyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-cyclohexyl-5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-cyclohexyl-5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]barbituric acid Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=O)N(C3=O)C4CCCCC4

Isomeric SMILES

CCC(CC1=CNC2=CC=CC=C21)NC=C3C(=O)NC(=O)N(C3=O)C4CCCCC4

InChI

InChI=1S/C23H28N4O3/c1-2-16(12-15-13-25-20-11-7-6-10-18(15)20)24-14-19-21(28)26-23(30)27(22(19)29)17-8-4-3-5-9-17/h6-7,10-11,13-14,16-17,24-25H,2-5,8-9,12H2,1H3,(H,26,28,30)