N-(3-methylsulfanylphenyl)-2-[(4-methylsulfonylphenyl)amino]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-[(4-methylsulfonylphenyl)amino]-1,3-thiazole-4-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)-2-(4-methylsulfonylanilino)thiazole-4-carboxamide CAS Name: 2-(4-methylsulfonylanilino)-N-[3-(methylthio)phenyl]-4-thiazolecarboxamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-(4-methylsulfonylanilino)-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-mesylanilino)-N-[3-(methylthio)phenyl]thiazole-4-carboxamide Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2=CSC(=N2)NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2=CSC(=N2)NC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H17N3O3S3/c1-25-14-5-3-4-13(10-14)19-17(22)16-11-26-18(21-16)20-12-6-8-15(9-7-12)27(2,23)24/h3-11H,1-2H3,(H,19,22)(H,20,21)