1-butyl-3-[4-[(3-methylphenyl)amino]pyridin-3-yl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-[(3-methylphenyl)amino]pyridin-3-yl]sulfonyl-urea Openeye Name: 1-butyl-3-[[4-(3-methylanilino)-3-pyridyl]sulfonyl]urea CAS Name: 1-butyl-3-[[4-(3-methylanilino)-3-pyridinyl]sulfonyl]urea IUPAC Name: 1-butyl-3-[4-(3-methylanilino)pyridin-3-yl]sulfonylurea Traditional Name: 1-butyl-3-[[4-(m-toluidino)-3-pyridyl]sulfonyl]urea Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=C(C=CN=C1)NC2=CC=CC(=C2)C

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=C(C=CN=C1)NC2=CC=CC(=C2)C

InChI

InChI=1S/C17H22N4O3S/c1-3-4-9-19-17(22)21-25(23,24)16-12-18-10-8-15(16)20-14-7-5-6-13(2)11-14/h5-8,10-12H,3-4,9H2,1-2H3,(H,18,20)(H2,19,21,22)