1-cyclopentyl-1-methyl-3-(3-phenethylsulfanyl-2H-pyran-2-yl)-3-(phenylmethyl)urea

Systemtic Name: 1-cyclopentyl-1-methyl-3-(3-phenethylsulfanyl-2H-pyran-2-yl)-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-cyclopentyl-3-methyl-1-(3-phenethylsulfanyl-2H-pyran-2-yl)urea CAS Name: 1-cyclopentyl-1-methyl-3-[3-(phenethylthio)-2H-pyran-2-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-cyclopentyl-3-methyl-1-(3-phenethylsulfanyl-2H-pyran-2-yl)urea Traditional Name: 1-benzyl-3-cyclopentyl-3-methyl-1-[3-(phenethylthio)-2H-pyran-2-yl]urea Formula: C27H32N2O2S MolecularWeight: 448.62018

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC1)C(=O)N(CC2=CC=CC=C2)C3C(=CC=CO3)SCCC4=CC=CC=C4

Isomeric SMILES

CN(C1CCCC1)C(=O)N(CC2=CC=CC=C2)C3C(=CC=CO3)SCCC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O2S/c1-28(24-15-8-9-16-24)27(30)29(21-23-13-6-3-7-14-23)26-25(17-10-19-31-26)32-20-18-22-11-4-2-5-12-22/h2-7,10-14,17,19,24,26H,8-9,15-16,18,20-21H2,1H3