(2R,3S)-4-cyclopentyl-2-(cyclopropylmethyl)-N-[(3S)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-butanamide

Systemtic Name: (2R,3S)-4-cyclopentyl-2-(cyclopropylmethyl)-N-[(3S)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-butanamide Openeye Name: (2R,3S)-4-cyclopentyl-2-(cyclopropylmethyl)-3-hydroxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]butanamide CAS Name: (2R,3S)-4-cyclopentyl-2-(cyclopropylmethyl)-3-hydroxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]butanamide IUPAC Name: (2R,3S)-4-cyclopentyl-2-(cyclopropylmethyl)-3-hydroxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]butanamide Traditional Name: (2R,3S)-4-cyclopentyl-2-(cyclopropylmethyl)-3-hydroxy-N-[(3S)-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl]butyramide Formula: C29H35N3O3 MolecularWeight: 473.6065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C(CC3CC3)C(CC4CCCC4)O)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@@H](C1=O)NC(=O)[C@H](CC3CC3)[C@H](CC4CCCC4)O)C5=CC=CC=C5

InChI

InChI=1S/C29H35N3O3/c1-32-24-14-8-7-13-22(24)26(21-11-3-2-4-12-21)30-27(29(32)35)31-28(34)23(17-20-15-16-20)25(33)18-19-9-5-6-10-19/h2-4,7-8,11-14,19-20,23,25,27,33H,5-6,9-10,15-18H2,1H3,(H,31,34)/t23-,25+,27-/m1/s1