N-(4-methoxyphenyl)-2-[2-oxidanylidene-3-(phenylcarbamoylamino)-5-pyridin-3-yl-3H-1,4-benzodiazepin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-[2-oxidanylidene-3-(phenylcarbamoylamino)-5-pyridin-3-yl-3H-1,4-benzodiazepin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-N-(4-methoxyphenyl)-2-[2-oxo-3-(phenylcarbamoylamino)-5-(3-pyridyl)-3H-1,4-benzodiazepin-1-yl]acetamide CAS Name: 2-[3-[[anilino(oxo)methyl]amino]-2-oxo-5-(3-pyridinyl)-3H-1,4-benzodiazepin-1-yl]-N-(4-methoxyphenyl)-N-propan-2-ylacetamide IUPAC Name: N-(4-methoxyphenyl)-2-[2-oxo-3-(phenylcarbamoylamino)-5-pyridin-3-yl-3H-1,4-benzodiazepin-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[2-keto-3-(phenylcarbamoylamino)-5-(3-pyridyl)-3H-1,4-benzodiazepin-1-yl]-N-(4-methoxyphenyl)acetamide Formula: C33H32N6O4 MolecularWeight: 576.64498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)OC)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)OC)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C33H32N6O4/c1-22(2)39(25-15-17-26(43-3)18-16-25)29(40)21-38-28-14-8-7-13-27(28)30(23-10-9-19-34-20-23)36-31(32(38)41)37-33(42)35-24-11-5-4-6-12-24/h4-20,22,31H,21H2,1-3H3,(H2,35,37,42)