N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-(2-oxidanylpentyl)cyclohexane-1-carboxamide

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-(2-oxidanylpentyl)cyclohexane-1-carboxamide Openeye Name: 1-(2-hydroxypentyl)-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide CAS Name: 1-(2-hydroxypentyl)-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-cyclohexanecarboxamide IUPAC Name: 1-(2-hydroxypentyl)-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide Traditional Name: 1-(2-hydroxypentyl)-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Formula: C28H35N3O3 MolecularWeight: 461.5958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1(CCCCC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C)O

Isomeric SMILES

CCCC(CC1(CCCCC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C)O

InChI

InChI=1S/C28H35N3O3/c1-3-12-21(32)19-28(17-10-5-11-18-28)27(34)30-25-26(33)31(2)23-16-9-8-15-22(23)24(29-25)20-13-6-4-7-14-20/h4,6-9,13-16,21,25,32H,3,5,10-12,17-19H2,1-2H3,(H,30,34)