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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic 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 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H19ClN6O3 MolecularWeight: 426.85626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN6O3/c21-14-8-6-13(7-9-14)18(29)23-11-10-17(28)30-12-16-25-19(22)27-20(26-16)24-15-4-2-1-3-5-15/h1-9H,10-12H2,(H,23,29)(H3,22,24,25,26,27)