1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]thiourea CAS Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methylphenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[5-[(4-chlorophenyl)sulfamoyl]-2-methylphenyl]thiourea Traditional Name: 1-benzyl-3-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]thiourea Formula: C21H20ClN3O2S2 MolecularWeight: 445.9854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Cl)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Cl)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20ClN3O2S2/c1-15-7-12-19(29(26,27)25-18-10-8-17(22)9-11-18)13-20(15)24-21(28)23-14-16-5-3-2-4-6-16/h2-13,25H,14H2,1H3,(H2,23,24,28)