[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: [1-methyl-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [2-keto-1-methyl-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethyl] ester Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)OC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)OC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C17H14ClN3O3S/c1-9-3-4-12-13(7-9)25-17(20-12)21-15(22)10(2)24-16(23)11-5-6-19-14(18)8-11/h3-8,10H,1-2H3,(H,20,21,22)