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

Systemtic Name: [4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methyl 2-thiophen-2-ylethanoate Openeye Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid [4-amino-6-(2-ethylanilino)-s-triazin-2-yl]methyl ester Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)CC3=CC=CS3

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)CC3=CC=CS3

InChI

InChI=1S/C18H19N5O2S/c1-2-12-6-3-4-8-14(12)20-18-22-15(21-17(19)23-18)11-25-16(24)10-13-7-5-9-26-13/h3-9H,2,10-11H2,1H3,(H3,19,20,21,22,23)