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

Systemtic Name: 1-butyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-butyl-5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-butyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-butyl-5-[[1-(1H-indol-3-yl)butan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-butyl-5-[[1-(1H-indol-3-ylmethyl)propylamino]methylene]barbituric acid Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CNC(CC)CC2=CNC3=CC=CC=C32)C(=O)NC1=O

Isomeric SMILES

CCCCN1C(=O)C(=CNC(CC)CC2=CNC3=CC=CC=C32)C(=O)NC1=O

InChI

InChI=1S/C21H26N4O3/c1-3-5-10-25-20(27)17(19(26)24-21(25)28)13-22-15(4-2)11-14-12-23-18-9-7-6-8-16(14)18/h6-9,12-13,15,22-23H,3-5,10-11H2,1-2H3,(H,24,26,28)