methyl 2-[2-[(2R)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(2R)-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[(2R)-1-(2-thienylsulfonyl)pyrrolidine-2-carbonyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[oxo-[(2R)-1-thiophen-2-ylsulfonyl-2-pyrrolidinyl]methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2R)-1-thiophen-2-ylsulfonylpyrrolidine-2-carbonyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[(2R)-1-(2-thienylsulfonyl)prolyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C19H19N3O5S3 MolecularWeight: 465.56626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2SC1=NC(=O)[C@H]3CCCN3S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H19N3O5S3/c1-27-16(23)12-21-13-6-2-3-8-15(13)29-19(21)20-18(24)14-7-4-10-22(14)30(25,26)17-9-5-11-28-17/h2-3,5-6,8-9,11,14H,4,7,10,12H2,1H3/t14-/m1/s1