N-[4-[8-chloranyl-3-(naphthalen-2-ylmethyl)-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-pyrimidin-5-yl-ethanamide

Systemtic Name: N-[4-[8-chloranyl-3-(naphthalen-2-ylmethyl)-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-pyrimidin-5-yl-ethanamide Openeye Name: N-[4-[8-chloro-3-(2-naphthylmethyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-pyrimidin-5-yl-acetamide CAS Name: N-[4-[8-chloro-3-(2-naphthalenylmethyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-(5-pyrimidinyl)acetamide IUPAC Name: N-[4-[8-chloro-3-(naphthalen-2-ylmethyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-pyrimidin-5-ylacetamide Traditional Name: N-[4-[8-chloro-2-keto-3-(2-naphthylmethyl)-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-(5-pyrimidyl)acetamide Formula: C32H24ClN5O2 MolecularWeight: 546.01826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC3C(=O)NC4=C(C=CC(=C4)Cl)C(=N3)C5=CC=C(C=C5)NC(=O)CC6=CN=CN=C6

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC3C(=O)NC4=C(C=CC(=C4)Cl)C(=N3)C5=CC=C(C=C5)NC(=O)CC6=CN=CN=C6

InChI

InChI=1S/C32H24ClN5O2/c33-25-9-12-27-28(16-25)38-32(40)29(14-20-5-6-22-3-1-2-4-24(22)13-20)37-31(27)23-7-10-26(11-8-23)36-30(39)15-21-17-34-19-35-18-21/h1-13,16-19,29H,14-15H2,(H,36,39)(H,38,40)