N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide Openeye Name: N-[5-[2-(p-tolylsulfonyl)ethyl]-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide CAS Name: N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide Traditional Name: N-[5-(2-tosylethyl)-1,3,4-thiadiazol-2-yl]nicotinamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H16N4O3S2/c1-12-4-6-14(7-5-12)26(23,24)10-8-15-20-21-17(25-15)19-16(22)13-3-2-9-18-11-13/h2-7,9,11H,8,10H2,1H3,(H,19,21,22)