2-azanyl-5-(hydroxymethyl)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid

Systemtic Name: 2-azanyl-5-(hydroxymethyl)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Openeye Name: 2-amino-6-benzyl-5-(hydroxymethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid CAS Name: 2-amino-5-(hydroxymethyl)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid IUPAC Name: 2-amino-6-benzyl-5-(hydroxymethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Traditional Name: 2-amino-6-benzyl-5-methylol-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C1C(=C(S2)N)C(=O)O)CC3=CC=CC=C3)CO

Isomeric SMILES

C1C(N(CC2=C1C(=C(S2)N)C(=O)O)CC3=CC=CC=C3)CO

InChI

InChI=1S/C16H18N2O3S/c17-15-14(16(20)21)12-6-11(9-19)18(8-13(12)22-15)7-10-4-2-1-3-5-10/h1-5,11,19H,6-9,17H2,(H,20,21)