N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-2-thiophenyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C23H21N3O3S3 MolecularWeight: 483.62614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H21N3O3S3/c1-15-8-10-16(11-9-15)32(28,29)26-13-4-6-19(26)21(27)25-22-17(12-14-30-22)23-24-18-5-2-3-7-20(18)31-23/h2-3,5,7-12,14,19H,4,6,13H2,1H3,(H,25,27)