2-azanyl-3-[4-(4-methoxyphenyl)pyrimidin-2-yl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[4-(4-methoxyphenyl)pyrimidin-2-yl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[4-(4-methoxyphenyl)pyrimidin-2-yl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[4-(4-methoxyphenyl)-2-pyrimidinyl]thio]propanoic acid IUPAC Name: 2-amino-3-[4-(4-methoxyphenyl)pyrimidin-2-yl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[4-(4-methoxyphenyl)pyrimidin-2-yl]thio]propionic acid Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NC=C2)SCC(C(=O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NC=C2)SCC(C(=O)O)N

InChI

InChI=1S/C14H15N3O3S/c1-20-10-4-2-9(3-5-10)12-6-7-16-14(17-12)21-8-11(15)13(18)19/h2-7,11H,8,15H2,1H3,(H,18,19)