1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: N-benzyl-1-[(5-chloro-2-thienyl)sulfonyl]-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: N-benzyl-1-(5-chlorothiophen-2-yl)sulfonyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-benzyl-1-[(5-chloro-2-thienyl)sulfonyl]-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C25H24ClN3O3S3 MolecularWeight: 546.12436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C25H24ClN3O3S3/c1-16-13-19-21(14-17(16)2)33-25(27-19)28(15-18-7-4-3-5-8-18)24(30)20-9-6-12-29(20)35(31,32)23-11-10-22(26)34-23/h3-5,7-8,10-11,13-14,20H,6,9,12,15H2,1-2H3