3,4-dimethyl-5-[1-(3-oxidanylidenepropyl)-1,2,4-triazol-3-yl]thiophene-2-carbonitrile

Systemtic Name: 3,4-dimethyl-5-[1-(3-oxidanylidenepropyl)-1,2,4-triazol-3-yl]thiophene-2-carbonitrile Openeye Name: 3,4-dimethyl-5-[1-(3-oxopropyl)-1,2,4-triazol-3-yl]thiophene-2-carbonitrile CAS Name: 3,4-dimethyl-5-[1-(3-oxopropyl)-1,2,4-triazol-3-yl]-2-thiophenecarbonitrile IUPAC Name: 3,4-dimethyl-5-[1-(3-oxopropyl)-1,2,4-triazol-3-yl]thiophene-2-carbonitrile Traditional Name: 5-[1-(3-ketopropyl)-1,2,4-triazol-3-yl]-3,4-dimethyl-thiophene-2-carbonitrile Formula: C12H12N4OS MolecularWeight: 260.31488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C)C2=NN(C=N2)CCC=O)C#N

Isomeric SMILES

CC1=C(SC(=C1C)C2=NN(C=N2)CCC=O)C#N

InChI

InChI=1S/C12H12N4OS/c1-8-9(2)11(18-10(8)6-13)12-14-7-16(15-12)4-3-5-17/h5,7H,3-4H2,1-2H3