[3-[(5-cyano-1,3-thiazol-2-yl)carbamoyl]phenyl] methanesulfonate

Systemtic Name: [3-[(5-cyano-1,3-thiazol-2-yl)carbamoyl]phenyl] methanesulfonate Openeye Name: [3-[(5-cyanothiazol-2-yl)carbamoyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[(5-cyano-2-thiazolyl)amino]-oxomethyl]phenyl] ester IUPAC Name: [3-[(5-cyano-1,3-thiazol-2-yl)carbamoyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[(5-cyanothiazol-2-yl)carbamoyl]phenyl] ester Formula: C12H9N3O4S2 MolecularWeight: 323.34756

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=CC(=C1)C(=O)NC2=NC=C(S2)C#N

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC(=C1)C(=O)NC2=NC=C(S2)C#N

InChI

InChI=1S/C12H9N3O4S2/c1-21(17,18)19-9-4-2-3-8(5-9)11(16)15-12-14-7-10(6-13)20-12/h2-5,7H,1H3,(H,14,15,16)