1-[2,6-bis(methylsulfanyl)phenyl]sulfonyl-3-(4-chloranyl-6-methoxy-pyrimidin-2-yl)urea

Systemtic Name: 1-[2,6-bis(methylsulfanyl)phenyl]sulfonyl-3-(4-chloranyl-6-methoxy-pyrimidin-2-yl)urea Openeye Name: 1-[2,6-bis(methylsulfanyl)phenyl]sulfonyl-3-(4-chloro-6-methoxy-pyrimidin-2-yl)urea CAS Name: 1-[2,6-bis(methylthio)phenyl]sulfonyl-3-(4-chloro-6-methoxy-2-pyrimidinyl)urea IUPAC Name: 1-[2,6-bis(methylsulfanyl)phenyl]sulfonyl-3-(4-chloro-6-methoxypyrimidin-2-yl)urea Traditional Name: 1-[2,6-bis(methylthio)phenyl]sulfonyl-3-(4-chloro-6-methoxy-pyrimidin-2-yl)urea Formula: C14H15ClN4O4S3 MolecularWeight: 434.9413

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=C2SC)SC)Cl

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=C2SC)SC)Cl

InChI

InChI=1S/C14H15ClN4O4S3/c1-23-11-7-10(15)16-13(17-11)18-14(20)19-26(21,22)12-8(24-2)5-4-6-9(12)25-3/h4-7H,1-3H3,(H2,16,17,18,19,20)