N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H22N6OS MolecularWeight: 370.47188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N6OS/c1-3-7-16-20-18(22-21-16)26-13-17(25)23(2)11-14-10-19-24(12-14)15-8-5-4-6-9-15/h4-6,8-10,12H,3,7,11,13H2,1-2H3,(H,20,21,22)