5-(2-methylpiperazin-1-yl)-3-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 5-(2-methylpiperazin-1-yl)-3-phenyl-thiophene-2-carboxylic acid Openeye Name: 5-(2-methylpiperazin-1-yl)-3-phenyl-thiophene-2-carboxylic acid CAS Name: 5-(2-methyl-1-piperazinyl)-3-phenyl-2-thiophenecarboxylic acid IUPAC Name: 5-(2-methylpiperazin-1-yl)-3-phenylthiophene-2-carboxylic acid Traditional Name: 5-(2-methylpiperazino)-3-phenyl-2-thenoic acid Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1C2=CC(=C(S2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1CNCCN1C2=CC(=C(S2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H18N2O2S/c1-11-10-17-7-8-18(11)14-9-13(15(21-14)16(19)20)12-5-3-2-4-6-12/h2-6,9,11,17H,7-8,10H2,1H3,(H,19,20)