1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: N-benzyl-1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: N-benzyl-1-(5-chlorothiophen-2-yl)sulfonyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-benzyl-1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,7-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=C2C(=C(C=C1)C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(S5)Cl

InChI

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