4-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methoxy-N-(4-phenylthiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methoxy-N-(4-phenyl-2-thiazolyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-N-(4-phenylthiazol-2-yl)-3-pyrrolidinosulfonyl-benzamide Formula: C21H21N3O4S2 MolecularWeight: 443.53914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H21N3O4S2/c1-28-18-10-9-16(13-19(18)30(26,27)24-11-5-6-12-24)20(25)23-21-22-17(14-29-21)15-7-3-2-4-8-15/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H,22,23,25)