1-(4,6-dimethylpyrimidin-2-yl)-3-(2-phenylphenyl)sulfonyl-thiourea

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(2-phenylphenyl)sulfonyl-thiourea Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(2-phenylphenyl)sulfonyl-thiourea CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-3-(2-phenylphenyl)sulfonylthiourea IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(2-phenylphenyl)sulfonylthiourea Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(2-phenylphenyl)sulfonyl-thiourea Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=S)NS(=O)(=O)C2=CC=CC=C2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=S)NS(=O)(=O)C2=CC=CC=C2C3=CC=CC=C3)C

InChI

InChI=1S/C19H18N4O2S2/c1-13-12-14(2)21-18(20-13)22-19(26)23-27(24,25)17-11-7-6-10-16(17)15-8-4-3-5-9-15/h3-12H,1-2H3,(H2,20,21,22,23,26)