N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide Openeye Name: N-(2-cyanoethyl)-N-(2-furylmethyl)-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide CAS Name: N-(2-cyanoethyl)-N-(2-furanylmethyl)-5-[2-(methylthio)-4-pyrimidinyl]-2-thiophenesulfonamide IUPAC Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-5-(2-methylsulfanylpyrimidin-4-yl)thiophene-2-sulfonamide Traditional Name: N-(2-cyanoethyl)-N-(2-furfuryl)-5-[2-(methylthio)pyrimidin-4-yl]thiophene-2-sulfonamide Formula: C17H16N4O3S3 MolecularWeight: 420.52894

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CC=C(S2)S(=O)(=O)N(CCC#N)CC3=CC=CO3

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CC=C(S2)S(=O)(=O)N(CCC#N)CC3=CC=CO3

InChI

InChI=1S/C17H16N4O3S3/c1-25-17-19-9-7-14(20-17)15-5-6-16(26-15)27(22,23)21(10-3-8-18)12-13-4-2-11-24-13/h2,4-7,9,11H,3,10,12H2,1H3