9-chloranyl-7-phenyl-3-(piperidin-1-ylmethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one

Systemtic Name: 9-chloranyl-7-phenyl-3-(piperidin-1-ylmethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Openeye Name: 9-chloro-7-phenyl-3-(1-piperidylmethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one CAS Name: 9-chloro-7-phenyl-3-(1-piperidinylmethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one IUPAC Name: 9-chloro-7-phenyl-3-(piperidin-1-ylmethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Traditional Name: 9-chloro-7-phenyl-3-(piperidinomethyl)-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Formula: C23H24ClN5O MolecularWeight: 421.92256

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C(=O)CN3C(=N2)CN=C(C4=C3C=CC(=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CN2C(=O)CN3C(=N2)CN=C(C4=C3C=CC(=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C23H24ClN5O/c24-18-9-10-20-19(13-18)23(17-7-3-1-4-8-17)25-14-21-26-29(22(30)15-28(20)21)16-27-11-5-2-6-12-27/h1,3-4,7-10,13H,2,5-6,11-12,14-16H2