ethyl 2-[[6-[(4-methylphenyl)carbonylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[6-[(4-methylphenyl)carbonylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[6-[(4-methylbenzoyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[6-[[(4-methylphenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[6-[(4-methylbenzoyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[6-(p-toluoylamino)-1,3-benzothiazol-2-yl]thio]acetic acid ethyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H18N2O3S2/c1-3-24-17(22)11-25-19-21-15-9-8-14(10-16(15)26-19)20-18(23)13-6-4-12(2)5-7-13/h4-10H,3,11H2,1-2H3,(H,20,23)