1-[4-[2,6-bis(chloranyl)-3-methyl-phenyl]sulfanylpyridin-3-yl]sulfonyl-3-butyl-urea

Systemtic Name: 1-[4-[2,6-bis(chloranyl)-3-methyl-phenyl]sulfanylpyridin-3-yl]sulfonyl-3-butyl-urea Openeye Name: 1-butyl-3-[[4-(2,6-dichloro-3-methyl-phenyl)sulfanyl-3-pyridyl]sulfonyl]urea CAS Name: 1-butyl-3-[[4-[(2,6-dichloro-3-methylphenyl)thio]-3-pyridinyl]sulfonyl]urea IUPAC Name: 1-butyl-3-[4-(2,6-dichloro-3-methylphenyl)sulfanylpyridin-3-yl]sulfonylurea Traditional Name: 1-butyl-3-[[4-[(2,6-dichloro-3-methyl-phenyl)thio]-3-pyridyl]sulfonyl]urea Formula: C17H19Cl2N3O3S2 MolecularWeight: 448.38706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=C(C=CN=C1)SC2=C(C=CC(=C2Cl)C)Cl

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=C(C=CN=C1)SC2=C(C=CC(=C2Cl)C)Cl

InChI

InChI=1S/C17H19Cl2N3O3S2/c1-3-4-8-21-17(23)22-27(24,25)14-10-20-9-7-13(14)26-16-12(18)6-5-11(2)15(16)19/h5-7,9-10H,3-4,8H2,1-2H3,(H2,21,22,23)