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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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