1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]thiourea Formula: C16H18FN3OS MolecularWeight: 319.397023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C16H18FN3OS/c1-10-7-11(2)20-15(21)14(10)9-19-16(22)18-8-12-3-5-13(17)6-4-12/h3-7H,8-9H2,1-2H3,(H,20,21)(H2,18,19,22)