(3-chloranyl-1-benzothiophen-2-yl)methyl 2-[methyl(thiophen-2-ylsulfonyl)amino]ethanoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 2-[methyl(thiophen-2-ylsulfonyl)amino]ethanoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 2-[methyl(2-thienylsulfonyl)amino]acetate CAS Name: 2-[methyl(thiophen-2-ylsulfonyl)amino]acetic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate Traditional Name: 2-[methyl(2-thienylsulfonyl)amino]acetic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C16H14ClNO4S3 MolecularWeight: 415.93466

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC1=C(C2=CC=CC=C2S1)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CC(=O)OCC1=C(C2=CC=CC=C2S1)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H14ClNO4S3/c1-18(25(20,21)15-7-4-8-23-15)9-14(19)22-10-13-16(17)11-5-2-3-6-12(11)24-13/h2-8H,9-10H2,1H3