[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 6-methyl-2,3-dihydrobenzothiophene-2-carboxylate CAS Name: 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Traditional Name: 6-methyl-2,3-dihydrobenzothiophene-2-carboxylic acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)OCC3=NC(=NC(=N3)N(C)C)N)C=C1

Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)OCC3=NC(=NC(=N3)N(C)C)N)C=C1

InChI

InChI=1S/C16H19N5O2S/c1-9-4-5-10-7-12(24-11(10)6-9)14(22)23-8-13-18-15(17)20-16(19-13)21(2)3/h4-6,12H,7-8H2,1-3H3,(H2,17,18,19,20)