4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(Z)-(3-tert-butyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(Z)-(3-tert-butyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C14H18N6S MolecularWeight: 302.39792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=NN2C(=NNC2=S)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=N\N2C(=NNC2=S)C(C)(C)C

InChI

InChI=1S/C14H18N6S/c1-9-10(6-11(7-15)19(9)5)8-16-20-12(14(2,3)4)17-18-13(20)21/h6,8H,1-5H3,(H,18,21)/b16-8-