1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C26H25ClN4O3S2 MolecularWeight: 541.0847

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H25ClN4O3S2/c1-2-18-7-5-10-23-24(18)29-26(35-23)30(17-20-8-3-4-15-28-20)25(32)22-9-6-16-31(22)36(33,34)21-13-11-19(27)12-14-21/h3-5,7-8,10-15,22H,2,6,9,16-17H2,1H3