1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)thiourea Openeye Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(4-methyl-2-morpholinosulfonyl-phenyl)thiourea CAS Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-[4-methyl-2-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-(4-methyl-2-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(4-methyl-2-morpholinosulfonyl-phenyl)thiourea Formula: C21H28N4O5S3 MolecularWeight: 512.66582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N(C)C)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N(C)C)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H28N4O5S3/c1-15-5-8-18(20(13-15)33(28,29)25-9-11-30-12-10-25)22-21(31)23-19-14-17(7-6-16(19)2)32(26,27)24(3)4/h5-8,13-14H,9-12H2,1-4H3,(H2,22,23,31)