(2R,3S)-2-(furan-2-ylmethyl)-N-[(3S)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-heptanamide

Systemtic Name: (2R,3S)-2-(furan-2-ylmethyl)-N-[(3S)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-heptanamide Openeye Name: (2R,3S)-2-(2-furylmethyl)-3-hydroxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]heptanamide CAS Name: (2R,3S)-2-(2-furanylmethyl)-3-hydroxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]heptanamide IUPAC Name: (2R,3S)-2-(furan-2-ylmethyl)-3-hydroxy-N-[(3S)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]heptanamide Traditional Name: (2R,3S)-2-(2-furfuryl)-3-hydroxy-N-[(3S)-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl]enanthamide Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC1=CC=CO1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C)O

Isomeric SMILES

CCCC[C@@H]([C@@H](CC1=CC=CO1)C(=O)N[C@@H]2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C)O

InChI

InChI=1S/C28H31N3O4/c1-3-4-16-24(32)22(18-20-13-10-17-35-20)27(33)30-26-28(34)31(2)23-15-9-8-14-21(23)25(29-26)19-11-6-5-7-12-19/h5-15,17,22,24,26,32H,3-4,16,18H2,1-2H3,(H,30,33)/t22-,24+,26-/m1/s1