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

Systemtic Name: 1-(4-butoxyphenyl)-3-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]urea Openeye Name: 1-(4-butoxyphenyl)-3-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]urea CAS Name: 1-(4-butoxyphenyl)-3-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]urea IUPAC Name: 1-(4-butoxyphenyl)-3-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]urea Traditional Name: 1-(4-butoxyphenyl)-3-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]urea Formula: C23H25ClN2O4S2 MolecularWeight: 493.0386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN2O4S2/c1-2-3-14-30-19-10-8-18(9-11-19)26-23(27)25-16-22(21-5-4-15-31-21)32(28,29)20-12-6-17(24)7-13-20/h4-13,15,22H,2-3,14,16H2,1H3,(H2,25,26,27)