1,3-benzothiazol-2-ylmethyl 2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]acetate Traditional Name: 2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C15H13ClN2O4S3 MolecularWeight: 416.92272

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC1=NC2=CC=CC=C2S1)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CN(CC(=O)OCC1=NC2=CC=CC=C2S1)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C15H13ClN2O4S3/c1-18(25(20,21)15-7-6-12(16)24-15)8-14(19)22-9-13-17-10-4-2-3-5-11(10)23-13/h2-7H,8-9H2,1H3