1-butyl-3-[4-methyl-3-(methylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-butyl-3-[4-methyl-3-(methylsulfamoyl)phenyl]thiourea Openeye Name: 1-butyl-3-[4-methyl-3-(methylsulfamoyl)phenyl]thiourea CAS Name: 1-butyl-3-[4-methyl-3-(methylsulfamoyl)phenyl]thiourea IUPAC Name: 1-butyl-3-[4-methyl-3-(methylsulfamoyl)phenyl]thiourea Traditional Name: 1-butyl-3-[4-methyl-3-(methylsulfamoyl)phenyl]thiourea Formula: C13H21N3O2S2 MolecularWeight: 315.45474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC(=C(C=C1)C)S(=O)(=O)NC

Isomeric SMILES

CCCCNC(=S)NC1=CC(=C(C=C1)C)S(=O)(=O)NC

InChI

InChI=1S/C13H21N3O2S2/c1-4-5-8-15-13(19)16-11-7-6-10(2)12(9-11)20(17,18)14-3/h6-7,9,14H,4-5,8H2,1-3H3,(H2,15,16,19)