N-(1-methyl-3-oxidanylidene-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-5-yl)-1H-indole-2-carboxamide

Systemtic Name: N-(1-methyl-3-oxidanylidene-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-5-yl)-1H-indole-2-carboxamide Openeye Name: N-(1-methyl-3-oxo-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-5-yl)-1H-indole-2-carboxamide CAS Name: N-(1-methyl-3-oxo-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-5-yl)-1H-indole-2-carboxamide IUPAC Name: N-(1-methyl-3-oxo-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-5-yl)-1H-indole-2-carboxamide Traditional Name: N-(3-keto-1-methyl-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-5-yl)-1H-indole-2-carboxamide Formula: C28H21N5O2 MolecularWeight: 459.49864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1C3=CC=CC=C3C(=NC2NC(=O)C4=CC5=CC=CC=C5N4)C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=O)N=C2N1C3=CC=CC=C3C(=NC2NC(=O)C4=CC5=CC=CC=C5N4)C6=CC=CC=C6

InChI

InChI=1S/C28H21N5O2/c1-17-15-24(34)30-27-26(32-28(35)22-16-19-11-5-7-13-21(19)29-22)31-25(18-9-3-2-4-10-18)20-12-6-8-14-23(20)33(17)27/h2-16,26,29H,1H3,(H,32,35)