4-phenyl-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate

Systemtic Name: 4-phenyl-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: 3-benzyl-4-phenyl-2-thioxo-thiazole-5-carboxylate CAS Name: 4-phenyl-3-(phenylmethyl)-2-sulfanylidene-5-thiazolecarboxylate IUPAC Name: 3-benzyl-4-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 3-benzyl-4-phenyl-2-thioxo-4-thiazoline-5-carboxylate Formula: C17H12NO2S2- MolecularWeight: 326.41268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(SC2=S)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(SC2=S)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H13NO2S2/c19-16(20)15-14(13-9-5-2-6-10-13)18(17(21)22-15)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,19,20)/p-1