1-(4-ethylphenyl)-3-[2-(phenylmethylsulfanyl)ethyl]urea

Systemtic Name: 1-(4-ethylphenyl)-3-[2-(phenylmethylsulfanyl)ethyl]urea Openeye Name: 1-(2-benzylsulfanylethyl)-3-(4-ethylphenyl)urea CAS Name: 1-(4-ethylphenyl)-3-[2-(phenylmethylthio)ethyl]urea IUPAC Name: 1-(2-benzylsulfanylethyl)-3-(4-ethylphenyl)urea Traditional Name: 1-[2-(benzylthio)ethyl]-3-(4-ethylphenyl)urea Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2OS/c1-2-15-8-10-17(11-9-15)20-18(21)19-12-13-22-14-16-6-4-3-5-7-16/h3-11H,2,12-14H2,1H3,(H2,19,20,21)