4-chloranyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-3-pyrrolidinosulfonyl-benzamide Formula: C22H22ClN3O5S2 MolecularWeight: 508.01018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22ClN3O5S2/c1-30-15-6-8-19(31-2)16(12-15)18-13-32-22(24-18)25-21(27)14-5-7-17(23)20(11-14)33(28,29)26-9-3-4-10-26/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,24,25,27)