1-(2-methylphenyl)-3-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]urea

Systemtic Name: 1-(2-methylphenyl)-3-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]urea Openeye Name: 1-(o-tolyl)-3-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]urea CAS Name: 1-(2-methylphenyl)-3-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]urea IUPAC Name: 1-(2-methylphenyl)-3-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]urea Traditional Name: 1-(o-tolyl)-3-[2-(2-thienyl)-2-tosyl-ethyl]urea Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NC2=CC=CC=C2C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NC2=CC=CC=C2C)C3=CC=CS3

InChI

InChI=1S/C21H22N2O3S2/c1-15-9-11-17(12-10-15)28(25,26)20(19-8-5-13-27-19)14-22-21(24)23-18-7-4-3-6-16(18)2/h3-13,20H,14H2,1-2H3,(H2,22,23,24)