2-(6-phenyl-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl)ethanoic acid

Systemtic Name: 2-(6-phenyl-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl)ethanoic acid Openeye Name: 2-[6-phenyl-4-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-(6-phenyl-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl)acetic acid IUPAC Name: 2-(6-phenyl-2-sulfanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl)acetic acid Traditional Name: 2-[6-phenyl-4-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid Formula: C16H14N2O2S2 MolecularWeight: 330.42456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(NC(=S)N2)C3=CC=CS3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(NC(=S)N2)C3=CC=CS3)CC(=O)O

InChI

InChI=1S/C16H14N2O2S2/c19-13(20)9-11-14(10-5-2-1-3-6-10)17-16(21)18-15(11)12-7-4-8-22-12/h1-8,15H,9H2,(H,19,20)(H2,17,18,21)