2-(3-azanyl-2-oxidanylidene-5-pyridin-3-yl-3H-1,4-benzodiazepin-1-yl)-N-(4-methoxyphenyl)-N-propan-2-yl-ethanamide dihydrobromide

Systemtic Name: 2-(3-azanyl-2-oxidanylidene-5-pyridin-3-yl-3H-1,4-benzodiazepin-1-yl)-N-(4-methoxyphenyl)-N-propan-2-yl-ethanamide dihydrobromide Openeye Name: 2-[3-amino-2-oxo-5-(3-pyridyl)-3H-1,4-benzodiazepin-1-yl]-N-isopropyl-N-(4-methoxyphenyl)acetamide dihydrobromide CAS Name: 2-[3-amino-2-oxo-5-(3-pyridinyl)-3H-1,4-benzodiazepin-1-yl]-N-(4-methoxyphenyl)-N-propan-2-ylacetamide dihydrobromide IUPAC Name: 2-(3-amino-2-oxo-5-pyridin-3-yl-3H-1,4-benzodiazepin-1-yl)-N-(4-methoxyphenyl)-N-propan-2-ylacetamide dihydrobromide Traditional Name: 2-[3-amino-2-keto-5-(3-pyridyl)-3H-1,4-benzodiazepin-1-yl]-N-isopropyl-N-(4-methoxyphenyl)acetamide dihydrobromide Formula: C26H29Br2N5O3 MolecularWeight: 619.34816

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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)N)C4=CN=CC=C4.Br.Br

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)OC)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)N)C4=CN=CC=C4.Br.Br

InChI

InChI=1S/C26H27N5O3.2BrH/c1-17(2)31(19-10-12-20(34-3)13-11-19)23(32)16-30-22-9-5-4-8-21(22)24(29-25(27)26(30)33)18-7-6-14-28-15-18;;/h4-15,17,25H,16,27H2,1-3H3;2*1H