1-(2-cyclohexylethyl)-3-(pyridin-4-ylmethyl)-1-(thiolan-2-ylmethyl)urea

Systemtic Name: 1-(2-cyclohexylethyl)-3-(pyridin-4-ylmethyl)-1-(thiolan-2-ylmethyl)urea Openeye Name: 1-(2-cyclohexylethyl)-3-(4-pyridylmethyl)-1-(tetrahydrothiophen-2-ylmethyl)urea CAS Name: 1-(2-cyclohexylethyl)-3-(pyridin-4-ylmethyl)-1-(2-thiolanylmethyl)urea IUPAC Name: 1-(2-cyclohexylethyl)-3-(pyridin-4-ylmethyl)-1-(thiolan-2-ylmethyl)urea Traditional Name: 1-(2-cyclohexylethyl)-3-(4-pyridylmethyl)-1-(tetrahydrothiophen-2-ylmethyl)urea Formula: C20H31N3OS MolecularWeight: 361.54464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN(CC2CCCS2)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1CCC(CC1)CCN(CC2CCCS2)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C20H31N3OS/c24-20(22-15-18-8-11-21-12-9-18)23(16-19-7-4-14-25-19)13-10-17-5-2-1-3-6-17/h8-9,11-12,17,19H,1-7,10,13-16H2,(H,22,24)