6-[4-(7-methoxy-2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]-N-phenyl-pyrimidine-4-carboxamide

Systemtic Name: 6-[4-(7-methoxy-2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]-N-phenyl-pyrimidine-4-carboxamide Openeye Name: 6-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidyl]-N-phenyl-pyrimidine-4-carboxamide CAS Name: 6-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidinyl]-N-phenyl-4-pyrimidinecarboxamide IUPAC Name: 6-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]-N-phenylpyrimidine-4-carboxamide Traditional Name: 6-[4-(2-keto-7-methoxy-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidino]-N-phenyl-pyrimidine-4-carboxamide Formula: C26H28N6O3 MolecularWeight: 472.53892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)N(CC2)C3CCN(CC3)C4=NC=NC(=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)N(CC2)C3CCN(CC3)C4=NC=NC(=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C26H28N6O3/c1-35-21-7-8-22-18(15-21)9-14-32(26(34)30-22)20-10-12-31(13-11-20)24-16-23(27-17-28-24)25(33)29-19-5-3-2-4-6-19/h2-8,15-17,20H,9-14H2,1H3,(H,29,33)(H,30,34)