1-(4-butylphenyl)-3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[4-(mesitylsulfamoyl)phenyl]thiourea Formula: C26H31N3O2S2 MolecularWeight: 481.67324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C26H31N3O2S2/c1-5-6-7-21-8-10-22(11-9-21)27-26(32)28-23-12-14-24(15-13-23)33(30,31)29-25-19(3)16-18(2)17-20(25)4/h8-17,29H,5-7H2,1-4H3,(H2,27,28,32)