2-[(3-methylphenyl)carbamoylamino]-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3-methylphenyl)carbamoylamino]-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(m-tolylcarbamoylamino)-N-[2-(4-sulfamoylphenyl)ethyl]thiazole-4-carboxamide CAS Name: 2-[[(3-methylanilino)-oxomethyl]amino]-N-[2-(4-sulfamoylphenyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[(3-methylphenyl)carbamoylamino]-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(m-tolylcarbamoylamino)-N-[2-(4-sulfamoylphenyl)ethyl]thiazole-4-carboxamide Formula: C20H21N5O4S2 MolecularWeight: 459.54184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21N5O4S2/c1-13-3-2-4-15(11-13)23-19(27)25-20-24-17(12-30-20)18(26)22-10-9-14-5-7-16(8-6-14)31(21,28)29/h2-8,11-12H,9-10H2,1H3,(H,22,26)(H2,21,28,29)(H2,23,24,25,27)