1-(2-ethyl-6-methyl-phenyl)-3-(3-pyridin-3-ylpropanoylamino)thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-(3-pyridin-3-ylpropanoylamino)thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[3-(3-pyridyl)propanoylamino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[1-oxo-3-(3-pyridinyl)propyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-(3-pyridin-3-ylpropanoylamino)thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[3-(3-pyridyl)propanoylamino]thiourea Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCC2=CN=CC=C2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCC2=CN=CC=C2)C

InChI

InChI=1S/C18H22N4OS/c1-3-15-8-4-6-13(2)17(15)20-18(24)22-21-16(23)10-9-14-7-5-11-19-12-14/h4-8,11-12H,3,9-10H2,1-2H3,(H,21,23)(H2,20,22,24)