(2R)-2-acetamido-N,4-dimethyl-N-[1-oxidanylidene-3-phenyl-1-[[(Z)-2-(6-phenylmethoxy-1H-pyrrolo[3,2-c]pyridin-3-yl)ethenyl]amino]propan-2-yl]pentanamide

Systemtic Name: (2R)-2-acetamido-N,4-dimethyl-N-[1-oxidanylidene-3-phenyl-1-[[(Z)-2-(6-phenylmethoxy-1H-pyrrolo[3,2-c]pyridin-3-yl)ethenyl]amino]propan-2-yl]pentanamide Openeye Name: (2R)-2-acetamido-N-[1-benzyl-2-[[(Z)-2-(6-benzyloxy-1H-pyrrolo[3,2-c]pyridin-3-yl)vinyl]amino]-2-oxo-ethyl]-N,4-dimethyl-pentanamide CAS Name: (2R)-2-acetamido-N,4-dimethyl-N-[1-oxo-3-phenyl-1-[[(Z)-2-(6-phenylmethoxy-1H-pyrrolo[3,2-c]pyridin-3-yl)ethenyl]amino]propan-2-yl]pentanamide IUPAC Name: (2R)-2-acetamido-N,4-dimethyl-N-[1-oxo-3-phenyl-1-[[(Z)-2-(6-phenylmethoxy-1H-pyrrolo[3,2-c]pyridin-3-yl)ethenyl]amino]propan-2-yl]pentanamide Traditional Name: (2R)-2-acetamido-N-[2-[[(Z)-2-(6-benzoxy-1H-pyrrolo[3,2-c]pyridin-3-yl)vinyl]amino]-1-benzyl-2-keto-ethyl]-N,4-dimethyl-valeramide Formula: C34H39N5O4 MolecularWeight: 581.70456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC=CC2=CNC3=CC(=NC=C32)OCC4=CC=CC=C4)NC(=O)C

Isomeric SMILES

CC(C)C[C@H](C(=O)N(C)C(CC1=CC=CC=C1)C(=O)N/C=C\C2=CNC3=CC(=NC=C32)OCC4=CC=CC=C4)NC(=O)C

InChI

InChI=1S/C34H39N5O4/c1-23(2)17-30(38-24(3)40)34(42)39(4)31(18-25-11-7-5-8-12-25)33(41)35-16-15-27-20-36-29-19-32(37-21-28(27)29)43-22-26-13-9-6-10-14-26/h5-16,19-21,23,30-31,36H,17-18,22H2,1-4H3,(H,35,41)(H,38,40)/b16-15-/t30-,31?/m1/s1