4-(1,3-benzothiazol-2-ylsulfanyl)but-2-ynyl naphthalene-1-carboxylate

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)but-2-ynyl naphthalene-1-carboxylate Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)but-2-ynyl naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid 4-(1,3-benzothiazol-2-ylthio)but-2-ynyl ester IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)but-2-ynyl naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid 4-(1,3-benzothiazol-2-ylthio)but-2-ynyl ester Formula: C22H15NO2S2 MolecularWeight: 389.49

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)OCC#CCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)OCC#CCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H15NO2S2/c24-21(18-11-7-9-16-8-1-2-10-17(16)18)25-14-5-6-15-26-22-23-19-12-3-4-13-20(19)27-22/h1-4,7-13H,14-15H2