3-[2-cyanoethyl-[(4-cyclopropyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-[(4-cyclopropyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]amino]propanenitrile Openeye Name: 3-[2-cyanoethyl-[[4-cyclopropyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]propanenitrile CAS Name: 3-[2-cyanoethyl-[(4-cyclopropyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]amino]propanenitrile IUPAC Name: 3-[2-cyanoethyl-[(4-cyclopropyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]amino]propanenitrile Traditional Name: 3-[2-cyanoethyl-[[4-cyclopropyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]propionitrile Formula: C16H18N6S2 MolecularWeight: 358.48432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)CN(CCC#N)CCC#N)C3=CC=CS3

Isomeric SMILES

C1CC1N2C(=NN(C2=S)CN(CCC#N)CCC#N)C3=CC=CS3

InChI

InChI=1S/C16H18N6S2/c17-7-2-9-20(10-3-8-18)12-21-16(23)22(13-5-6-13)15(19-21)14-4-1-11-24-14/h1,4,11,13H,2-3,5-6,9-10,12H2