5-azanyl-1-(4-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(4-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(4-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-(4-methyl-1,3-benzothiazol-2-yl)-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(4-methyl-1,3-benzothiazol-2-yl)-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-(4-methyl-1,3-benzothiazol-2-yl)-3-(methylthio)pyrazole-4-carbonitrile Formula: C13H11N5S2 MolecularWeight: 301.38994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N3C(=C(C(=N3)SC)C#N)N

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N3C(=C(C(=N3)SC)C#N)N

InChI

InChI=1S/C13H11N5S2/c1-7-4-3-5-9-10(7)16-13(20-9)18-11(15)8(6-14)12(17-18)19-2/h3-5H,15H2,1-2H3