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

Systemtic Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methylphenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methylphenyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-[3-(methylthio)propyl]thiourea Formula: C18H22ClN3O2S3 MolecularWeight: 444.03418

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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)NCCCSC

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3O2S3/c1-13-4-9-16(12-17(13)21-18(25)20-10-3-11-26-2)27(23,24)22-15-7-5-14(19)6-8-15/h4-9,12,22H,3,10-11H2,1-2H3,(H2,20,21,25)