N-benzo[e][1,3]benzothiazol-2-yl-1-(5-chloranylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(5-chloranylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide Formula: C20H16ClN3O3S3 MolecularWeight: 478.00734

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C20H16ClN3O3S3/c21-16-9-10-17(29-16)30(26,27)24-11-3-6-14(24)19(25)23-20-22-18-13-5-2-1-4-12(13)7-8-15(18)28-20/h1-2,4-5,7-10,14H,3,6,11H2,(H,22,23,25)