(2R,3S)-N-(5-cycloheptyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-oxidanyl-heptanamide

Systemtic Name: (2R,3S)-N-(5-cycloheptyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-oxidanyl-heptanamide Openeye Name: (2R,3S)-N-(5-cycloheptyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxy-heptanamide CAS Name: (2R,3S)-N-(5-cycloheptyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxyheptanamide IUPAC Name: (2R,3S)-N-(5-cycloheptyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxyheptanamide Traditional Name: (2R,3S)-N-(5-cycloheptyl-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxy-enanthamide Formula: C28H41N3O3 MolecularWeight: 467.64344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4CCCCCC4)C)O

Isomeric SMILES

CCCC[C@@H]([C@@H](CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4CCCCCC4)C)O

InChI

InChI=1S/C28H41N3O3/c1-3-4-15-24(32)22(18-19-16-17-19)27(33)30-26-28(34)31(2)23-14-10-9-13-21(23)25(29-26)20-11-7-5-6-8-12-20/h9-10,13-14,19-20,22,24,26,32H,3-8,11-12,15-18H2,1-2H3,(H,30,33)/t22-,24+,26?/m1/s1