N-(2,6-dimethoxypyridin-3-yl)-N-methylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2,6-dimethoxypyridin-3-yl)-N-methylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethoxy-3-pyridyl)-N-methylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethoxy-3-pyridinyl)-N-methylsulfonyl-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethoxypyridin-3-yl)-N-methylsulfonyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethoxy-3-pyridyl)-N-mesyl-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C20H18N4O5S2 MolecularWeight: 458.51072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)N(C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4)S(=O)(=O)C)OC

Isomeric SMILES

COC1=NC(=C(C=C1)N(C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4)S(=O)(=O)C)OC

InChI

InChI=1S/C20H18N4O5S2/c1-28-17-9-8-15(18(22-17)29-2)24(31(3,26)27)19(25)13-6-7-14-16(12-13)30-20(21-14)23-10-4-5-11-23/h4-12H,1-3H3