N-(3-fluoranyl-4-methoxy-phenyl)-N-propylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methoxy-phenyl)-N-propylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(3-fluoro-4-methoxy-phenyl)-N-propylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(3-fluoro-4-methoxyphenyl)-N-propylsulfonyl-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3-fluoro-4-methoxyphenyl)-N-propylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(3-fluoro-4-methoxy-phenyl)-N-propylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C22H20FN3O4S2 MolecularWeight: 473.540303

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C22H20FN3O4S2/c1-3-12-32(28,29)26(16-7-9-19(30-2)17(23)14-16)21(27)15-6-8-18-20(13-15)31-22(24-18)25-10-4-5-11-25/h4-11,13-14H,3,12H2,1-2H3