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

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(3-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=CN=CC=C3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

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