[4-azanyl-6-[(2-methoxyphenyl)amino]-1,3,5-triazin-2-yl]methyl 2,5-dimethylthiophene-3-carboxylate

Systemtic Name: [4-azanyl-6-[(2-methoxyphenyl)amino]-1,3,5-triazin-2-yl]methyl 2,5-dimethylthiophene-3-carboxylate Openeye Name: [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 2,5-dimethylthiophene-3-carboxylate CAS Name: 2,5-dimethyl-3-thiophenecarboxylic acid [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 2,5-dimethylthiophene-3-carboxylate Traditional Name: 2,5-dimethylthiophene-3-carboxylic acid [4-amino-6-(o-anisidino)-s-triazin-2-yl]methyl ester Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N

InChI

InChI=1S/C18H19N5O3S/c1-10-8-12(11(2)27-10)16(24)26-9-15-21-17(19)23-18(22-15)20-13-6-4-5-7-14(13)25-3/h4-8H,9H2,1-3H3,(H3,19,20,21,22,23)