5-cyclopentyl-2-(cyclopropylmethyl)-N-[5-(4-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-pentanamide

Systemtic Name: 5-cyclopentyl-2-(cyclopropylmethyl)-N-[5-(4-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-pentanamide Openeye Name: 5-cyclopentyl-2-(cyclopropylmethyl)-N-[5-(4-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-hydroxy-pentanamide CAS Name: 5-cyclopentyl-2-(cyclopropylmethyl)-N-[5-(4-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-hydroxypentanamide IUPAC Name: 5-cyclopentyl-2-(cyclopropylmethyl)-N-[5-(4-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-hydroxypentanamide Traditional Name: 5-cyclopentyl-2-(cyclopropylmethyl)-N-[5-(4-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]-3-hydroxy-valeramide Formula: C30H36FN3O3 MolecularWeight: 505.623543

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C(CC3CC3)C(CCC4CCCC4)O)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C(CC3CC3)C(CCC4CCCC4)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C30H36FN3O3/c1-34-25-9-5-4-8-23(25)27(21-13-15-22(31)16-14-21)32-28(30(34)37)33-29(36)24(18-20-10-11-20)26(35)17-12-19-6-2-3-7-19/h4-5,8-9,13-16,19-20,24,26,28,35H,2-3,6-7,10-12,17-18H2,1H3,(H,33,36)