(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-[(4-chloropyridine-2-carbonyl)amino]acetate CAS Name: 2-[[(4-chloro-2-pyridinyl)-oxomethyl]amino]acetic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-[(4-chloropyridine-2-carbonyl)amino]acetate Traditional Name: 2-[(4-chloropicolinoyl)amino]acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C18H16ClN7O3 MolecularWeight: 413.81774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CNC(=O)C3=NC=CC(=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CNC(=O)C3=NC=CC(=C3)Cl

InChI

InChI=1S/C18H16ClN7O3/c19-11-6-7-21-13(8-11)16(28)22-9-15(27)29-10-14-24-17(20)26-18(25-14)23-12-4-2-1-3-5-12/h1-8H,9-10H2,(H,22,28)(H3,20,23,24,25,26)