2-azanylidene-4-methyl-3-(phenylmethyl)-1,3-thiazole-5-carboxylate

Systemtic Name: 2-azanylidene-4-methyl-3-(phenylmethyl)-1,3-thiazole-5-carboxylate Openeye Name: 3-benzyl-2-imino-4-methyl-thiazole-5-carboxylate CAS Name: 2-imino-4-methyl-3-(phenylmethyl)-5-thiazolecarboxylate IUPAC Name: 3-benzyl-2-imino-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 3-benzyl-2-imino-4-methyl-4-thiazoline-5-carboxylate Formula: C12H11N2O2S- MolecularWeight: 247.29294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N)N1CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=N)N1CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C12H12N2O2S/c1-8-10(11(15)16)17-12(13)14(8)7-9-5-3-2-4-6-9/h2-6,13H,7H2,1H3,(H,15,16)/p-1