2-[(4-ethoxyphenyl)amino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-ethoxyphenyl)amino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-ethoxyanilino)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(4-ethoxyanilino)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-(4-ethoxyanilino)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(p-phenetidino)thiazole-4-carboxamide Formula: C20H18N4O4S3 MolecularWeight: 474.57632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C20H18N4O4S3/c1-3-28-13-6-4-12(5-7-13)21-19-23-16(11-29-19)18(25)24-20-22-15-9-8-14(31(2,26)27)10-17(15)30-20/h4-11H,3H2,1-2H3,(H,21,23)(H,22,24,25)