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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(4-methylsulfonylphenyl)amino]-1,3-thiazole-4-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylanilino)thiazole-4-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylanilino)-4-thiazolecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-methylsulfonylanilino)-1,3-thiazole-4-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(4-mesylanilino)thiazole-4-carboxamide Formula: C20H18N4O4S3 MolecularWeight: 474.57632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)NC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)NC4=CC=C(C=C4)S(=O)(=O)C

InChI

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