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

Systemtic Name: N-(1H-indazol-4-yl)-6-[4-(7-methoxy-2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]pyrimidine-4-carboxamide Openeye Name: N-(1H-indazol-4-yl)-6-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidyl]pyrimidine-4-carboxamide CAS Name: N-(1H-indazol-4-yl)-6-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidinyl]-4-pyrimidinecarboxamide IUPAC Name: N-(1H-indazol-4-yl)-6-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]pyrimidine-4-carboxamide Traditional Name: N-(1H-indazol-4-yl)-6-[4-(2-keto-7-methoxy-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidino]pyrimidine-4-carboxamide Formula: C27H28N8O3 MolecularWeight: 512.56302

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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=CC6=C5C=NN6

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)N(CC2)C3CCN(CC3)C4=NC=NC(=C4)C(=O)NC5=CC=CC6=C5C=NN6

InChI

InChI=1S/C27H28N8O3/c1-38-19-5-6-21-17(13-19)7-12-35(27(37)32-21)18-8-10-34(11-9-18)25-14-24(28-16-29-25)26(36)31-22-3-2-4-23-20(22)15-30-33-23/h2-6,13-16,18H,7-12H2,1H3,(H,30,33)(H,31,36)(H,32,37)