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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]thiourea Formula: C16H18ClN3OS MolecularWeight: 335.85162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC2=C(C=C(NC2=O)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC2=C(C=C(NC2=O)C)C)Cl

InChI

InChI=1S/C16H18ClN3OS/c1-9-4-5-12(7-14(9)17)20-16(22)18-8-13-10(2)6-11(3)19-15(13)21/h4-7H,8H2,1-3H3,(H,19,21)(H2,18,20,22)