7-chloranyl-3-(4-methylpiperazin-1-yl)carbonyl-4-phenyl-1H-1,2,4-benzotriazepin-5-one

Systemtic Name: 7-chloranyl-3-(4-methylpiperazin-1-yl)carbonyl-4-phenyl-1H-1,2,4-benzotriazepin-5-one Openeye Name: 7-chloro-3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one CAS Name: 7-chloro-3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-phenyl-1H-1,2,4-benzotriazepin-5-one IUPAC Name: 7-chloro-3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one Traditional Name: 7-chloro-3-(4-methylpiperazine-1-carbonyl)-4-phenyl-1H-1,2,4-benzotriazepin-5-one Formula: C20H20ClN5O2 MolecularWeight: 397.8581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=NNC3=C(C=C(C=C3)Cl)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=NNC3=C(C=C(C=C3)Cl)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C20H20ClN5O2/c1-24-9-11-25(12-10-24)20(28)18-23-22-17-8-7-14(21)13-16(17)19(27)26(18)15-5-3-2-4-6-15/h2-8,13,22H,9-12H2,1H3