3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-cyclooctyl-1-[[4-(diethylamino)phenyl]methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-cyclooctyl-1-[4-(diethylamino)benzyl]-1-(3-pyridylmethyl)thiourea Formula: C26H38N4S MolecularWeight: 438.67172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3CCCCCCC3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C26H38N4S/c1-3-29(4-2)25-16-14-22(15-17-25)20-30(21-23-11-10-18-27-19-23)26(31)28-24-12-8-6-5-7-9-13-24/h10-11,14-19,24H,3-9,12-13,20-21H2,1-2H3,(H,28,31)