1-[4-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]-3-phenethyl-thiourea

Systemtic Name: 1-[4-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]-3-phenethyl-thiourea Openeye Name: 1-[4-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]-3-phenethyl-thiourea CAS Name: 1-[4-[(4-bromophenyl)sulfamoyl]-2-methoxyphenyl]-3-phenethylthiourea IUPAC Name: 1-[4-[(4-bromophenyl)sulfamoyl]-2-methoxyphenyl]-3-phenethylthiourea Traditional Name: 1-[4-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]-3-phenethyl-thiourea Formula: C22H22BrN3O3S2 MolecularWeight: 520.46238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)Br)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)Br)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H22BrN3O3S2/c1-29-21-15-19(31(27,28)26-18-9-7-17(23)8-10-18)11-12-20(21)25-22(30)24-14-13-16-5-3-2-4-6-16/h2-12,15,26H,13-14H2,1H3,(H2,24,25,30)