5-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-[(1-ethyltetrazol-5-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-[[(1-ethyl-5-tetrazolyl)thio]methyl]-3-methyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-[(1-ethyltetrazol-5-yl)sulfanylmethyl]-3-methyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-[[(1-ethyltetrazol-5-yl)thio]methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Formula: C15H15N7S MolecularWeight: 325.3915

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCC2=C(C(=NN2C3=CC=CC=C3)C)C#N

Isomeric SMILES

CCN1C(=NN=N1)SCC2=C(C(=NN2C3=CC=CC=C3)C)C#N

InChI

InChI=1S/C15H15N7S/c1-3-21-15(17-19-20-21)23-10-14-13(9-16)11(2)18-22(14)12-7-5-4-6-8-12/h4-8H,3,10H2,1-2H3