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

Systemtic Name: (2R,3S)-5-cyclopentyl-2-(cyclopropylmethyl)-3-methoxy-N-[(3S)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]pentanamide Openeye Name: (2R,3S)-5-cyclopentyl-2-(cyclopropylmethyl)-3-methoxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]pentanamide CAS Name: (2R,3S)-5-cyclopentyl-2-(cyclopropylmethyl)-3-methoxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]pentanamide IUPAC Name: (2R,3S)-5-cyclopentyl-2-(cyclopropylmethyl)-3-methoxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]pentanamide Traditional Name: (2R,3S)-5-cyclopentyl-2-(cyclopropylmethyl)-N-[(3S)-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-methoxy-valeramide Formula: C31H39N3O3 MolecularWeight: 501.65966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@@H](C1=O)NC(=O)[C@H](CC3CC3)[C@H](CCC4CCCC4)OC)C5=CC=CC=C5

InChI

InChI=1S/C31H39N3O3/c1-34-26-15-9-8-14-24(26)28(23-12-4-3-5-13-23)32-29(31(34)36)33-30(35)25(20-22-16-17-22)27(37-2)19-18-21-10-6-7-11-21/h3-5,8-9,12-15,21-22,25,27,29H,6-7,10-11,16-20H2,1-2H3,(H,33,35)/t25-,27+,29-/m1/s1