N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C17H16ClN3O3S3 MolecularWeight: 441.97524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C17H16ClN3O3S3/c1-10-8-11(18)9-13-15(10)19-17(26-13)20-16(22)12-4-2-6-21(12)27(23,24)14-5-3-7-25-14/h3,5,7-9,12H,2,4,6H2,1H3,(H,19,20,22)