1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-isoquinolin-5-yl-thiourea

Systemtic Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-isoquinolin-5-yl-thiourea Openeye Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(5-isoquinolyl)thiourea CAS Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-(5-isoquinolinyl)thiourea IUPAC Name: 1-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-isoquinolin-5-ylthiourea Traditional Name: 1-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(5-isoquinolyl)thiourea Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H20N4O2S2/c1-13-7-8-15(27(24,25)23(2)3)11-18(13)22-19(26)21-17-6-4-5-14-12-20-10-9-16(14)17/h4-12H,1-3H3,(H2,21,22,26)