N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetamide Formula: C21H19N3O4S3 MolecularWeight: 473.58826

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)NCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H19N3O4S3/c1-24(31(26,27)21-7-4-12-29-21)15-8-10-16(11-9-15)28-14-19(25)22-13-20-23-17-5-2-3-6-18(17)30-20/h2-12H,13-14H2,1H3,(H,22,25)