2-azanyl-3-(4-naphthalen-2-ylpyrimidin-2-yl)sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-(4-naphthalen-2-ylpyrimidin-2-yl)sulfanyl-propanoic acid Openeye Name: 2-amino-3-[4-(2-naphthyl)pyrimidin-2-yl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[4-(2-naphthalenyl)-2-pyrimidinyl]thio]propanoic acid IUPAC Name: 2-amino-3-(4-naphthalen-2-ylpyrimidin-2-yl)sulfanylpropanoic acid Traditional Name: 2-amino-3-[[4-(2-naphthyl)pyrimidin-2-yl]thio]propionic acid Formula: C17H15N3O2S MolecularWeight: 325.3849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NC(=NC=C3)SCC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NC(=NC=C3)SCC(C(=O)O)N

InChI

InChI=1S/C17H15N3O2S/c18-14(16(21)22)10-23-17-19-8-7-15(20-17)13-6-5-11-3-1-2-4-12(11)9-13/h1-9,14H,10,18H2,(H,21,22)