1-[2-(4,5-dihydro-1,3-thiazol-2-ylmethylsulfanyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea

Systemtic Name: 1-[2-(4,5-dihydro-1,3-thiazol-2-ylmethylsulfanyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea Openeye Name: 1-[2-(4,5-dihydrothiazol-2-ylmethylsulfanyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea CAS Name: 1-[2-(4,5-dihydrothiazol-2-ylmethylthio)phenyl]sulfonyl-3-(4-methoxy-6-methyl-2-pyrimidinyl)urea IUPAC Name: 1-[2-(4,5-dihydro-1,3-thiazol-2-ylmethylsulfanyl)phenyl]sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea Traditional Name: 1-(4-methoxy-6-methyl-pyrimidin-2-yl)-3-[2-(2-thiazolin-2-ylmethylthio)phenyl]sulfonyl-urea Formula: C17H19N5O4S3 MolecularWeight: 453.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2SCC3=NCCS3)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2SCC3=NCCS3)OC

InChI

InChI=1S/C17H19N5O4S3/c1-11-9-14(26-2)20-16(19-11)21-17(23)22-29(24,25)13-6-4-3-5-12(13)28-10-15-18-7-8-27-15/h3-6,9H,7-8,10H2,1-2H3,(H2,19,20,21,22,23)