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

Systemtic Name: 1-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-pentan-3-yl-urea Openeye Name: 1-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-3-(1-ethylpropyl)urea CAS Name: 1-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-3-pentan-3-ylurea IUPAC Name: 1-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-3-pentan-3-ylurea Traditional Name: 1-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-3-(1-ethylpropyl)urea Formula: C18H23ClN2O3S2 MolecularWeight: 414.96982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NCC(C1=CC=CS1)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(CC)NC(=O)NCC(C1=CC=CS1)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H23ClN2O3S2/c1-3-14(4-2)21-18(22)20-12-17(16-6-5-11-25-16)26(23,24)15-9-7-13(19)8-10-15/h5-11,14,17H,3-4,12H2,1-2H3,(H2,20,21,22)