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

Systemtic Name: N-[5-(4-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-1-(1-oxidanylpentyl)cyclohexane-1-carboxamide Openeye Name: N-[5-(4-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-1-(1-hydroxypentyl)cyclohexanecarboxamide CAS Name: N-[5-(4-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-1-(1-hydroxypentyl)-1-cyclohexanecarboxamide IUPAC Name: N-[5-(4-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-1-(1-hydroxypentyl)cyclohexane-1-carboxamide Traditional Name: N-[5-(4-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]-1-(1-hydroxypentyl)cyclohexanecarboxamide Formula: C28H34FN3O3 MolecularWeight: 479.586263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1(CCCCC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)F)C)O

Isomeric SMILES

CCCCC(C1(CCCCC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)F)C)O

InChI

InChI=1S/C28H34FN3O3/c1-3-4-12-23(33)28(17-8-5-9-18-28)27(35)31-25-26(34)32(2)22-11-7-6-10-21(22)24(30-25)19-13-15-20(29)16-14-19/h6-7,10-11,13-16,23,25,33H,3-5,8-9,12,17-18H2,1-2H3,(H,31,35)