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

Systemtic Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-(3-phenylpropyl)urea Openeye Name: 1-(3-phenylpropyl)-3-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]urea CAS Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(3-phenylpropyl)urea IUPAC Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-(3-phenylpropyl)urea Traditional Name: 1-(3-phenylpropyl)-3-[2-(2-thienyl)-2-tosyl-ethyl]urea Formula: C23H26N2O3S2 MolecularWeight: 442.59414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NCCCC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NCCCC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C23H26N2O3S2/c1-18-11-13-20(14-12-18)30(27,28)22(21-10-6-16-29-21)17-25-23(26)24-15-5-9-19-7-3-2-4-8-19/h2-4,6-8,10-14,16,22H,5,9,15,17H2,1H3,(H2,24,25,26)