2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]-N-(2,6-dimethylphenyl)acetamide Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC(=O)C=C(N2CC=C)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC(=O)C=C(N2CC=C)N

InChI

InChI=1S/C17H20N4O2S/c1-4-8-21-13(18)9-14(22)20-17(21)24-10-15(23)19-16-11(2)6-5-7-12(16)3/h4-7,9H,1,8,10,18H2,2-3H3,(H,19,23)