propan-2-yl 2-[2-(4-chlorophenyl)sulfanylethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-[2-(4-chlorophenyl)sulfanylethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-[(4-chlorophenyl)thio]acetyl]amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C19H17ClN2O3S2 MolecularWeight: 420.93288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O3S2/c1-11(2)25-18(24)12-3-8-15-16(9-12)27-19(21-15)22-17(23)10-26-14-6-4-13(20)5-7-14/h3-9,11H,10H2,1-2H3,(H,21,22,23)