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

Systemtic Name: 10-chloranyl-2-(1H-indol-3-ylmethyl)-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Openeye Name: 10-chloro-2-(1H-indol-3-ylmethyl)-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one CAS Name: 10-chloro-2-(1H-indol-3-ylmethyl)-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one IUPAC Name: 10-chloro-2-(1H-indol-3-ylmethyl)-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Traditional Name: 10-chloro-2-(1H-indol-3-ylmethyl)-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Formula: C21H15ClN4O MolecularWeight: 374.823

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CN=C(N=C2C3=C(C=CC(=C3)Cl)NC1=O)CC4=CNC5=CC=CC=C54

Isomeric SMILES

C1C2=CN=C(N=C2C3=C(C=CC(=C3)Cl)NC1=O)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C21H15ClN4O/c22-14-5-6-18-16(9-14)21-13(8-20(27)25-18)11-24-19(26-21)7-12-10-23-17-4-2-1-3-15(12)17/h1-6,9-11,23H,7-8H2,(H,25,27)