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

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]urea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]urea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]urea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]urea Traditional Name: 1-(4-chlorobenzyl)-3-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]urea Formula: C21H21ClN2O4S2 MolecularWeight: 464.98544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NCC2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NCC2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C21H21ClN2O4S2/c1-28-17-8-10-18(11-9-17)30(26,27)20(19-3-2-12-29-19)14-24-21(25)23-13-15-4-6-16(22)7-5-15/h2-12,20H,13-14H2,1H3,(H2,23,24,25)