3-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4,6-dimethyl-pyrimidin-5-yl]-N-(3,5-dimethylphenyl)propanamide

Systemtic Name: 3-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4,6-dimethyl-pyrimidin-5-yl]-N-(3,5-dimethylphenyl)propanamide Openeye Name: 3-[2-(2-amino-2-oxo-ethyl)sulfanyl-4,6-dimethyl-pyrimidin-5-yl]-N-(3,5-dimethylphenyl)propanamide CAS Name: 3-[2-[(2-amino-2-oxoethyl)thio]-4,6-dimethyl-5-pyrimidinyl]-N-(3,5-dimethylphenyl)propanamide IUPAC Name: 3-[2-(2-amino-2-oxoethyl)sulfanyl-4,6-dimethylpyrimidin-5-yl]-N-(3,5-dimethylphenyl)propanamide Traditional Name: 3-[2-[(2-amino-2-keto-ethyl)thio]-4,6-dimethyl-pyrimidin-5-yl]-N-(3,5-dimethylphenyl)propionamide Formula: C19H24N4O2S MolecularWeight: 372.48446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CCC2=C(N=C(N=C2C)SCC(=O)N)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CCC2=C(N=C(N=C2C)SCC(=O)N)C)C

InChI

InChI=1S/C19H24N4O2S/c1-11-7-12(2)9-15(8-11)23-18(25)6-5-16-13(3)21-19(22-14(16)4)26-10-17(20)24/h7-9H,5-6,10H2,1-4H3,(H2,20,24)(H,23,25)