1-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]thiourea

Systemtic Name: 1-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]thiourea Openeye Name: 1-[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]amino]-3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]thiourea CAS Name: 1-[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]amino]-3-[5-(dimethylsulfamoyl)-2-methylphenyl]thiourea IUPAC Name: 1-[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]amino]-3-[5-(dimethylsulfamoyl)-2-methylphenyl]thiourea Traditional Name: 1-[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]amino]-3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]thiourea Formula: C20H25BrN4O3S3 MolecularWeight: 545.5365

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NNC(=O)CSC2=C(C=C(C(=C2)C)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NNC(=O)CSC2=C(C=C(C(=C2)C)Br)C

InChI

InChI=1S/C20H25BrN4O3S3/c1-12-6-7-15(31(27,28)25(4)5)10-17(12)22-20(29)24-23-19(26)11-30-18-9-13(2)16(21)8-14(18)3/h6-10H,11H2,1-5H3,(H,23,26)(H2,22,24,29)