[4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl pentanoate

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl pentanoate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl pentanoate CAS Name: pentanoic acid [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl pentanoate Traditional Name: valeric acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC1=NC(=NC(=N1)NC2=CC=CC=C2C)N

Isomeric SMILES

CCCCC(=O)OCC1=NC(=NC(=N1)NC2=CC=CC=C2C)N

InChI

InChI=1S/C16H21N5O2/c1-3-4-9-14(22)23-10-13-19-15(17)21-16(20-13)18-12-8-6-5-7-11(12)2/h5-8H,3-4,9-10H2,1-2H3,(H3,17,18,19,20,21)