1-methyl-3-[(4-sulfamoylphenyl)methyl]thiourea

Systemtic Name: 1-methyl-3-[(4-sulfamoylphenyl)methyl]thiourea Openeye Name: 1-methyl-3-[(4-sulfamoylphenyl)methyl]thiourea CAS Name: 1-methyl-3-[(4-sulfamoylphenyl)methyl]thiourea IUPAC Name: 1-methyl-3-[(4-sulfamoylphenyl)methyl]thiourea Traditional Name: 1-methyl-3-(4-sulfamoylbenzyl)thiourea Formula: C9H13N3O2S2 MolecularWeight: 259.34842

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCC1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CNC(=S)NCC1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C9H13N3O2S2/c1-11-9(15)12-6-7-2-4-8(5-3-7)16(10,13)14/h2-5H,6H2,1H3,(H2,10,13,14)(H2,11,12,15)