1,3-benzothiazol-2-ylmethyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H15N3O2S2 MolecularWeight: 381.4713

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15N3O2S2/c1-25-19-20-11-15(22(19)13-7-3-2-4-8-13)18(23)24-12-17-21-14-9-5-6-10-16(14)26-17/h2-11H,12H2,1H3