(4-aminophenyl)-[1-(pyridin-3-ylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone

Systemtic Name: (4-aminophenyl)-[1-(pyridin-3-ylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Openeye Name: (4-aminophenyl)-[1-(3-pyridylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone CAS Name: (4-aminophenyl)-[1-(3-pyridinylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone IUPAC Name: (4-aminophenyl)-[1-(pyridin-3-ylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Traditional Name: (4-aminophenyl)-[1-(3-pyridylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2N(C1)C(=O)C3=CC=C(C=C3)N)CC4=CN=CC=C4

Isomeric SMILES

C1CN(C2=CC=CC=C2N(C1)C(=O)C3=CC=C(C=C3)N)CC4=CN=CC=C4

InChI

InChI=1S/C22H22N4O/c23-19-10-8-18(9-11-19)22(27)26-14-4-13-25(16-17-5-3-12-24-15-17)20-6-1-2-7-21(20)26/h1-3,5-12,15H,4,13-14,16,23H2