1-[[2-chloranyl-5-(methylsulfamoyl)phenyl]carbonylamino]-3-(3,4-dimethylphenyl)thiourea

Systemtic Name: 1-[[2-chloranyl-5-(methylsulfamoyl)phenyl]carbonylamino]-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-[[2-chloro-5-(methylsulfamoyl)benzoyl]amino]-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-[[[2-chloro-5-(methylsulfamoyl)phenyl]-oxomethyl]amino]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-[[2-chloro-5-(methylsulfamoyl)benzoyl]amino]-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-[[2-chloro-5-(methylsulfamoyl)benzoyl]amino]-3-(3,4-dimethylphenyl)thiourea Formula: C17H19ClN4O3S2 MolecularWeight: 426.94076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC)Cl)C

InChI

InChI=1S/C17H19ClN4O3S2/c1-10-4-5-12(8-11(10)2)20-17(26)22-21-16(23)14-9-13(6-7-15(14)18)27(24,25)19-3/h4-9,19H,1-3H3,(H,21,23)(H2,20,22,26)