N-[2-[1-[(2S)-2-acetamido-4-methyl-pentanoyl]piperidin-4-yl]pyrazol-3-yl]-3-methyl-butanamide

Systemtic Name: N-[2-[1-[(2S)-2-acetamido-4-methyl-pentanoyl]piperidin-4-yl]pyrazol-3-yl]-3-methyl-butanamide Openeye Name: N-[2-[1-[(2S)-2-acetamido-4-methyl-pentanoyl]-4-piperidyl]pyrazol-3-yl]-3-methyl-butanamide CAS Name: N-[2-[1-[(2S)-2-acetamido-4-methyl-1-oxopentyl]-4-piperidinyl]-3-pyrazolyl]-3-methylbutanamide IUPAC Name: N-[2-[1-[(2S)-2-acetamido-4-methylpentanoyl]piperidin-4-yl]pyrazol-3-yl]-3-methylbutanamide Traditional Name: N-[2-[1-[(2S)-2-acetamido-4-methyl-pentanoyl]-4-piperidyl]pyrazol-3-yl]-3-methyl-butyramide Formula: C21H35N5O3 MolecularWeight: 405.5343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CC(C)C)NC(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CC(C)C)NC(=O)C

InChI

InChI=1S/C21H35N5O3/c1-14(2)12-18(23-16(5)27)21(29)25-10-7-17(8-11-25)26-19(6-9-22-26)24-20(28)13-15(3)4/h6,9,14-15,17-18H,7-8,10-13H2,1-5H3,(H,23,27)(H,24,28)/t18-/m0/s1