1-(3-methylbutyl)-3-(4-methylphenyl)sulfonyl-urea

Systemtic Name: 1-(3-methylbutyl)-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-isopentyl-3-(p-tolylsulfonyl)urea CAS Name: 1-(3-methylbutyl)-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-(3-methylbutyl)-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-isoamyl-3-tosyl-urea Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C13H20N2O3S/c1-10(2)8-9-14-13(16)15-19(17,18)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3,(H2,14,15,16)