methyl 2-[(2Z)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(2Z)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[(2Z)-2-(2-thienylsulfonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2Z)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-(2-thienylsulfonylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C14H12N2O4S3 MolecularWeight: 368.45108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2SC1=NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)CN\1C2=CC=CC=C2S/C1=N\S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C14H12N2O4S3/c1-20-12(17)9-16-10-5-2-3-6-11(10)22-14(16)15-23(18,19)13-7-4-8-21-13/h2-8H,9H2,1H3/b15-14-