1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-methylphenyl)thiourea

Systemtic Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-methylphenyl)thiourea Openeye Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(m-tolyl)thiourea CAS Name: 1-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-methylphenyl)thiourea Traditional Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(m-tolyl)thiourea Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C20H21N5O2S2/c1-13-5-4-6-17(11-13)24-20(28)23-16-7-9-18(10-8-16)29(26,27)25-19-21-14(2)12-15(3)22-19/h4-12H,1-3H3,(H,21,22,25)(H2,23,24,28)