4-(4-methylpiperazin-1-yl)-3-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 4-(4-methylpiperazin-1-yl)-3-phenyl-thiophene-2-carboxylic acid Openeye Name: 4-(4-methylpiperazin-1-yl)-3-phenyl-thiophene-2-carboxylic acid CAS Name: 4-(4-methyl-1-piperazinyl)-3-phenyl-2-thiophenecarboxylic acid IUPAC Name: 4-(4-methylpiperazin-1-yl)-3-phenylthiophene-2-carboxylic acid Traditional Name: 4-(4-methylpiperazino)-3-phenyl-2-thenoic acid Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CSC(=C2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=CSC(=C2C3=CC=CC=C3)C(=O)O

InChI

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