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

Systemtic Name: 1-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-(4-methylphenyl)urea Openeye Name: 1-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]-3-(p-tolyl)urea CAS Name: 1-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(4-methylphenyl)urea Traditional Name: 1-[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]-3-(p-tolyl)urea Formula: C21H22N2O4S2 MolecularWeight: 430.54038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O4S2/c1-15-5-7-16(8-6-15)23-21(24)22-14-20(19-4-3-13-28-19)29(25,26)18-11-9-17(27-2)10-12-18/h3-13,20H,14H2,1-2H3,(H2,22,23,24)