1-(3,5-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-(4-sulfamoylbenzyl)thiourea Formula: C16H19N3O2S2 MolecularWeight: 349.47096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C16H19N3O2S2/c1-11-7-12(2)9-14(8-11)19-16(22)18-10-13-3-5-15(6-4-13)23(17,20)21/h3-9H,10H2,1-2H3,(H2,17,20,21)(H2,18,19,22)