butyl 2-[2-(4-chlorophenyl)ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[2-(4-chlorophenyl)ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[[2-(4-chlorophenyl)acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[2-(4-chlorophenyl)acetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(4-chlorophenyl)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-2-3-10-26-19(25)14-6-9-16-17(12-14)27-20(22-16)23-18(24)11-13-4-7-15(21)8-5-13/h4-9,12H,2-3,10-11H2,1H3,(H,22,23,24)