4-methyl-2-[(phenylmethyl)amino]-3H-1,3,4-benzotriazepin-5-one

Systemtic Name: 4-methyl-2-[(phenylmethyl)amino]-3H-1,3,4-benzotriazepin-5-one Openeye Name: 2-(benzylamino)-4-methyl-3H-1,3,4-benzotriazepin-5-one CAS Name: 4-methyl-2-[(phenylmethyl)amino]-3H-1,3,4-benzotriazepin-5-one IUPAC Name: 2-(benzylamino)-4-methyl-3H-1,3,4-benzotriazepin-5-one Traditional Name: 2-(benzylamino)-4-methyl-3H-1,3,4-benzotriazepin-5-one Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C(N1)NCC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C(N1)NCC3=CC=CC=C3

InChI

InChI=1S/C16H16N4O/c1-20-15(21)13-9-5-6-10-14(13)18-16(19-20)17-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H2,17,18,19)