5-azanyl-3-methanethioyl-1-methyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-methanethioyl-1-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-methanethioyl-1-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-methanethioyl-1-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-methanethioyl-1-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-methyl-3-thioformyl-pyrazole-4-carbonitrile Formula: C6H6N4S MolecularWeight: 166.20364

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C=S)C#N)N

Isomeric SMILES

CN1C(=C(C(=N1)C=S)C#N)N

InChI

InChI=1S/C6H6N4S/c1-10-6(8)4(2-7)5(3-11)9-10/h3H,8H2,1H3