1-(4-methoxy-5-methyl-pyrimidin-2-yl)-3-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)sulfonyl-urea

Systemtic Name: 1-(4-methoxy-5-methyl-pyrimidin-2-yl)-3-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)sulfonyl-urea Openeye Name: 1-(4-methoxy-5-methyl-pyrimidin-2-yl)-3-(6-thioxocyclohexa-1,3-dien-1-yl)sulfonyl-urea CAS Name: 1-(4-methoxy-5-methyl-2-pyrimidinyl)-3-[(6-sulfanylidene-1-cyclohexa-1,3-dienyl)sulfonyl]urea IUPAC Name: 1-(4-methoxy-5-methylpyrimidin-2-yl)-3-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)sulfonylurea Traditional Name: 1-(4-methoxy-5-methyl-pyrimidin-2-yl)-3-(6-thioxocyclohexa-1,3-dien-1-yl)sulfonyl-urea Formula: C13H14N4O4S2 MolecularWeight: 354.40466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1OC)NC(=O)NS(=O)(=O)C2=CC=CCC2=S

Isomeric SMILES

CC1=CN=C(N=C1OC)NC(=O)NS(=O)(=O)C2=CC=CCC2=S

InChI

InChI=1S/C13H14N4O4S2/c1-8-7-14-12(15-11(8)21-2)16-13(18)17-23(19,20)10-6-4-3-5-9(10)22/h3-4,6-7H,5H2,1-2H3,(H2,14,15,16,17,18)