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

Systemtic Name: 9-chloranyl-3-(dimethylaminomethyl)-7-phenyl-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Openeye Name: 9-chloro-3-(dimethylaminomethyl)-7-phenyl-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one CAS Name: 9-chloro-3-(dimethylaminomethyl)-7-phenyl-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one IUPAC Name: 9-chloro-3-(dimethylaminomethyl)-7-phenyl-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Traditional Name: 9-chloro-3-(dimethylaminomethyl)-7-phenyl-1,5-dihydro-[1,2,4]triazino[4,3-a][1,4]benzodiazepin-2-one Formula: C20H20ClN5O MolecularWeight: 381.8587

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CN1C(=O)CN2C(=N1)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CN(C)CN1C(=O)CN2C(=N1)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H20ClN5O/c1-24(2)13-26-19(27)12-25-17-9-8-15(21)10-16(17)20(22-11-18(25)23-26)14-6-4-3-5-7-14/h3-10H,11-13H2,1-2H3