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

Systemtic Name: (4-aminophenyl)-[1-(pyridin-4-ylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Openeye Name: (4-aminophenyl)-[1-(4-pyridylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone CAS Name: (4-aminophenyl)-[1-(pyridin-4-ylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone IUPAC Name: (4-aminophenyl)-[1-(pyridin-4-ylmethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Traditional Name: (4-aminophenyl)-[1-(4-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=CC=NC=C4

Isomeric SMILES

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

InChI

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