2-azanyl-6-methyl-4-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2-azanyl-6-methyl-4-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2-amino-6-methyl-4-(2-thienylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2-amino-6-methyl-4-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2-amino-6-methyl-4-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2-amino-6-methyl-4-(2-thenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)N)C(=O)O)CC2=CC=CS2)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)N)C(=O)O)CC2=CC=CS2)C(=O)O

InChI

InChI=1S/C13H14N2O4S/c1-6-9(12(16)17)8(5-7-3-2-4-20-7)10(13(18)19)11(14)15-6/h2-4,8,15H,5,14H2,1H3,(H,16,17)(H,18,19)