1-(phenylmethyl)sulfonyl-3-pyrimidin-2-yl-1-sulfanyl-urea

Systemtic Name: 1-(phenylmethyl)sulfonyl-3-pyrimidin-2-yl-1-sulfanyl-urea Openeye Name: 1-benzylsulfonyl-3-pyrimidin-2-yl-1-sulfanyl-urea CAS Name: 1-mercapto-1-(phenylmethyl)sulfonyl-3-(2-pyrimidinyl)urea IUPAC Name: 1-benzylsulfonyl-3-pyrimidin-2-yl-1-sulfanylurea Traditional Name: 1-benzylsulfonyl-1-mercapto-3-(2-pyrimidyl)urea Formula: C12H12N4O3S2 MolecularWeight: 324.37868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)N(C(=O)NC2=NC=CC=N2)S

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)N(C(=O)NC2=NC=CC=N2)S

InChI

InChI=1S/C12H12N4O3S2/c17-12(15-11-13-7-4-8-14-11)16(20)21(18,19)9-10-5-2-1-3-6-10/h1-8,20H,9H2,(H,13,14,15,17)