1-cyclohexyl-3-[4-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxidanylidene-butyl]urea

Systemtic Name: 1-cyclohexyl-3-[4-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxidanylidene-butyl]urea Openeye Name: 1-cyclohexyl-3-[4-oxo-4-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]butyl]urea CAS Name: 1-cyclohexyl-3-[4-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxobutyl]urea IUPAC Name: 1-cyclohexyl-3-[4-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxobutyl]urea Traditional Name: 1-cyclohexyl-3-[4-keto-4-(4-tosyl-1,4-diazepan-1-yl)butyl]urea Formula: C23H36N4O4S MolecularWeight: 464.62134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)CCCNC(=O)NC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)CCCNC(=O)NC3CCCCC3

InChI

InChI=1S/C23H36N4O4S/c1-19-10-12-21(13-11-19)32(30,31)27-16-6-15-26(17-18-27)22(28)9-5-14-24-23(29)25-20-7-3-2-4-8-20/h10-13,20H,2-9,14-18H2,1H3,(H2,24,25,29)