1-(4-methylphenyl)carbothioyl-3-methylsulfonyl-urea

Systemtic Name: 1-(4-methylphenyl)carbothioyl-3-methylsulfonyl-urea Openeye Name: 1-(4-methylbenzenecarbothioyl)-3-methylsulfonyl-urea CAS Name: 1-[(4-methylphenyl)-sulfanylidenemethyl]-3-methylsulfonylurea IUPAC Name: 1-(4-methylbenzenecarbothioyl)-3-methylsulfonylurea Traditional Name: 1-mesyl-3-(4-methylthiobenzoyl)urea Formula: C10H12N2O3S2 MolecularWeight: 272.34388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)NC(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)NC(=O)NS(=O)(=O)C

InChI

InChI=1S/C10H12N2O3S2/c1-7-3-5-8(6-4-7)9(16)11-10(13)12-17(2,14)15/h3-6H,1-2H3,(H2,11,12,13,16)