(2S)-3-methyl-N-[2-[(5-methylfuran-2-yl)methyl]pyrazol-3-yl]-2-(2-phenylethanoylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-[2-[(5-methylfuran-2-yl)methyl]pyrazol-3-yl]-2-(2-phenylethanoylamino)butanamide Openeye Name: (2S)-3-methyl-N-[2-[(5-methyl-2-furyl)methyl]pyrazol-3-yl]-2-[(2-phenylacetyl)amino]butanamide CAS Name: (2S)-3-methyl-N-[2-[(5-methyl-2-furanyl)methyl]-3-pyrazolyl]-2-[(1-oxo-2-phenylethyl)amino]butanamide IUPAC Name: (2S)-3-methyl-N-[2-[(5-methylfuran-2-yl)methyl]pyrazol-3-yl]-2-[(2-phenylacetyl)amino]butanamide Traditional Name: (2S)-3-methyl-N-[2-[(5-methyl-2-furyl)methyl]pyrazol-3-yl]-2-[(2-phenylacetyl)amino]butyramide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2C(=CC=N2)NC(=O)C(C(C)C)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(O1)CN2C(=CC=N2)NC(=O)[C@H](C(C)C)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O3/c1-15(2)21(25-20(27)13-17-7-5-4-6-8-17)22(28)24-19-11-12-23-26(19)14-18-10-9-16(3)29-18/h4-12,15,21H,13-14H2,1-3H3,(H,24,28)(H,25,27)/t21-/m0/s1