N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-butan-2-yl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-butan-2-yl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[(1S)-1-(benzotriazol-1-ylmethyl)-2-methyl-propyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[(2S)-1-(1-benzotriazolyl)-3-methylbutan-2-yl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-1-(benzotriazol-1-yl)-3-methylbutan-2-yl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[(1S)-1-(benzotriazol-1-ylmethyl)-2-methyl-propyl]-1-methyl-pyrazole-3-carboxamide Formula: C16H20N6O MolecularWeight: 312.3696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1C2=CC=CC=C2N=N1)NC(=O)C3=NN(C=C3)C

Isomeric SMILES

CC(C)[C@@H](CN1C2=CC=CC=C2N=N1)NC(=O)C3=NN(C=C3)C

InChI

InChI=1S/C16H20N6O/c1-11(2)14(17-16(23)13-8-9-21(3)19-13)10-22-15-7-5-4-6-12(15)18-20-22/h4-9,11,14H,10H2,1-3H3,(H,17,23)/t14-/m1/s1