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

Systemtic Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-pentan-3-yl-urea Openeye Name: 1-(1-ethylpropyl)-3-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]urea CAS Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-pentan-3-ylurea IUPAC Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-pentan-3-ylurea Traditional Name: 1-(1-ethylpropyl)-3-[2-(2-thienyl)-2-tosyl-ethyl]urea Formula: C19H26N2O3S2 MolecularWeight: 394.55134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O3S2/c1-4-15(5-2)21-19(22)20-13-18(17-7-6-12-25-17)26(23,24)16-10-8-14(3)9-11-16/h6-12,15,18H,4-5,13H2,1-3H3,(H2,20,21,22)