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

Systemtic Name: N-(2-azanyl-3-phenylmethoxy-butanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide Openeye Name: N-(2-amino-3-benzyloxy-butanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide CAS Name: N-(2-amino-1-oxo-3-phenylmethoxybutyl)-N'-methyl-N'-[2-(1-pyrazolyl)ethyl]butanediamide IUPAC Name: N-(2-amino-3-phenylmethoxybutanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)butanediamide Traditional Name: N-(2-amino-3-benzoxy-butanoyl)-N'-methyl-N'-(2-pyrazol-1-ylethyl)succinamide Formula: C21H29N5O4 MolecularWeight: 415.48606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(=O)CCC(=O)N(C)CCN1C=CC=N1)N)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(C(=O)NC(=O)CCC(=O)N(C)CCN1C=CC=N1)N)OCC2=CC=CC=C2

InChI

InChI=1S/C21H29N5O4/c1-16(30-15-17-7-4-3-5-8-17)20(22)21(29)24-18(27)9-10-19(28)25(2)13-14-26-12-6-11-23-26/h3-8,11-12,16,20H,9-10,13-15,22H2,1-2H3,(H,24,27,29)