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

Systemtic Name: [4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 3-thiophen-2-ylpropanoate Openeye Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic acid [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl 3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid [4-amino-6-(p-toluidino)-s-triazin-2-yl]methyl ester Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3=CC=CS3

InChI

InChI=1S/C18H19N5O2S/c1-12-4-6-13(7-5-12)20-18-22-15(21-17(19)23-18)11-25-16(24)9-8-14-3-2-10-26-14/h2-7,10H,8-9,11H2,1H3,(H3,19,20,21,22,23)