2-[(4-phenylazanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]propanoic acid

Systemtic Name: 2-[(4-phenylazanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]propanoic acid Openeye Name: 2-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]propanoic acid CAS Name: 2-[[4-anilino-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]propanoic acid IUPAC Name: 2-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]propanoic acid Traditional Name: 2-[(4-anilino-6-pyrrolidino-s-triazin-2-yl)amino]propionic acid Formula: C16H20N6O2 MolecularWeight: 328.369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=NC(=NC(=N1)NC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CC(C(=O)O)NC1=NC(=NC(=N1)NC2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C16H20N6O2/c1-11(13(23)24)17-14-19-15(18-12-7-3-2-4-8-12)21-16(20-14)22-9-5-6-10-22/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,23,24)(H2,17,18,19,20,21)