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

Systemtic Name: 5-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-3-methyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-methyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Formula: C14H12N6S2 MolecularWeight: 328.41528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSC2=NN=C(S2)N)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)CSC2=NN=C(S2)N)C3=CC=CC=C3

InChI

InChI=1S/C14H12N6S2/c1-9-11(7-15)12(8-21-14-18-17-13(16)22-14)20(19-9)10-5-3-2-4-6-10/h2-6H,8H2,1H3,(H2,16,17)