(2R)-2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(4-ethanoylphenyl)butanamide

Systemtic Name: (2R)-2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(4-ethanoylphenyl)butanamide Openeye Name: (2R)-N-(4-acetylphenyl)-2-(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanyl-butanamide CAS Name: (2R)-N-(4-acetylphenyl)-2-[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]butanamide IUPAC Name: (2R)-N-(4-acetylphenyl)-2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanylbutanamide Traditional Name: (2R)-N-(4-acetylphenyl)-2-[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]butyramide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC(=O)C=C(N2CC=C)N

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC(=O)C=C(N2CC=C)N

InChI

InChI=1S/C19H22N4O3S/c1-4-10-23-16(20)11-17(25)22-19(23)27-15(5-2)18(26)21-14-8-6-13(7-9-14)12(3)24/h4,6-9,11,15H,1,5,10,20H2,2-3H3,(H,21,26)/t15-/m1/s1