N-[2-azanyl-3-phenylmethoxy-2-(phenylmethyl)butanoyl]-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide

Systemtic Name: N-[2-azanyl-3-phenylmethoxy-2-(phenylmethyl)butanoyl]-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide Openeye Name: N-(2-amino-2-benzyl-3-benzyloxy-butanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide CAS Name: N-[2-amino-1-oxo-3-phenylmethoxy-2-(phenylmethyl)butyl]-N'-methyl-N'-[2-(1-pyrazolyl)ethyl]butanediamide IUPAC Name: N-(2-amino-2-benzyl-3-phenylmethoxybutanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide Traditional Name: N-(2-amino-3-benzoxy-2-benzyl-butanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)succinamide Formula: C28H35N5O4 MolecularWeight: 505.6086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC=C1)(C(=O)NC(=O)CCC(=O)N(C)CCN2C=CC=N2)N)OCC3=CC=CC=C3

Isomeric SMILES

CC(C(CC1=CC=CC=C1)(C(=O)NC(=O)CCC(=O)N(C)CCN2C=CC=N2)N)OCC3=CC=CC=C3

InChI

InChI=1S/C28H35N5O4/c1-22(37-21-24-12-7-4-8-13-24)28(29,20-23-10-5-3-6-11-23)27(36)31-25(34)14-15-26(35)32(2)18-19-33-17-9-16-30-33/h3-13,16-17,22H,14-15,18-21,29H2,1-2H3,(H,31,34,36)