N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-butan-2-yl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)propanamide

Systemtic Name: N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-butan-2-yl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)propanamide Openeye Name: N-[(1S)-1-(benzotriazol-1-ylmethyl)-2-methyl-propyl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)propanamide CAS Name: N-[(2S)-1-(1-benzotriazolyl)-3-methylbutan-2-yl]-3-(1-ethyl-3,5-dimethyl-4-pyrazolyl)propanamide IUPAC Name: N-[(2S)-1-(benzotriazol-1-yl)-3-methylbutan-2-yl]-3-(1-ethyl-3,5-dimethylpyrazol-4-yl)propanamide Traditional Name: N-[(1S)-1-(benzotriazol-1-ylmethyl)-2-methyl-propyl]-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)propionamide Formula: C21H30N6O MolecularWeight: 382.5025

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CCC(=O)NC(CN2C3=CC=CC=C3N=N2)C(C)C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CCC(=O)N[C@H](CN2C3=CC=CC=C3N=N2)C(C)C)C

InChI

InChI=1S/C21H30N6O/c1-6-26-16(5)17(15(4)24-26)11-12-21(28)22-19(14(2)3)13-27-20-10-8-7-9-18(20)23-25-27/h7-10,14,19H,6,11-13H2,1-5H3,(H,22,28)/t19-/m1/s1