1-butyl-3-[4-(4-chlorophenyl)sulfanylpyridin-3-yl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-(4-chlorophenyl)sulfanylpyridin-3-yl]sulfonyl-urea Openeye Name: 1-butyl-3-[[4-(4-chlorophenyl)sulfanyl-3-pyridyl]sulfonyl]urea CAS Name: 1-butyl-3-[[4-[(4-chlorophenyl)thio]-3-pyridinyl]sulfonyl]urea IUPAC Name: 1-butyl-3-[4-(4-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea Traditional Name: 1-butyl-3-[[4-[(4-chlorophenyl)thio]-3-pyridyl]sulfonyl]urea Formula: C16H18ClN3O3S2 MolecularWeight: 399.91542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=C(C=CN=C1)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=C(C=CN=C1)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H18ClN3O3S2/c1-2-3-9-19-16(21)20-25(22,23)15-11-18-10-8-14(15)24-13-6-4-12(17)5-7-13/h4-8,10-11H,2-3,9H2,1H3,(H2,19,20,21)