1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(2-pyridin-2-ylethyl)thiourea

Systemtic Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(2-pyridin-2-ylethyl)thiourea Openeye Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-[2-(2-pyridyl)ethyl]thiourea CAS Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-[2-(2-pyridinyl)ethyl]thiourea IUPAC Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-(2-pyridin-2-ylethyl)thiourea Traditional Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-[2-(2-pyridyl)ethyl]thiourea Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NCCC2=CC=CC=N2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NCCC2=CC=CC=N2

InChI

InChI=1S/C17H22N4O2S2/c1-13-7-8-15(25(22,23)21(2)3)12-16(13)20-17(24)19-11-9-14-6-4-5-10-18-14/h4-8,10,12H,9,11H2,1-3H3,(H2,19,20,24)