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

Systemtic Name: 1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-3-phenethyl-thiourea Openeye Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-phenethylthiourea IUPAC Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-phenethylthiourea Traditional Name: 1-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]-3-phenethyl-thiourea Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=S)NCCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=S)NCCC2=CC=CC=C2)C

InChI

InChI=1S/C17H21N3OS/c1-12-10-13(2)20-16(21)15(12)11-19-17(22)18-9-8-14-6-4-3-5-7-14/h3-7,10H,8-9,11H2,1-2H3,(H,20,21)(H2,18,19,22)