2-(1H-indol-3-ylmethyl)-9,10-dimethyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one

Systemtic Name: 2-(1H-indol-3-ylmethyl)-9,10-dimethyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Openeye Name: 2-(1H-indol-3-ylmethyl)-9,10-dimethyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one CAS Name: 2-(1H-indol-3-ylmethyl)-9,10-dimethyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one IUPAC Name: 2-(1H-indol-3-ylmethyl)-9,10-dimethyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Traditional Name: 2-(1H-indol-3-ylmethyl)-9,10-dimethyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Formula: C23H20N4O MolecularWeight: 368.4311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C3=NC(=NC=C3CC(=O)N2)CC4=CNC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C3=NC(=NC=C3CC(=O)N2)CC4=CNC5=CC=CC=C54)C

InChI

InChI=1S/C23H20N4O/c1-13-7-18-20(8-14(13)2)26-22(28)10-16-12-25-21(27-23(16)18)9-15-11-24-19-6-4-3-5-17(15)19/h3-8,11-12,24H,9-10H2,1-2H3,(H,26,28)