S-(1,3-benzothiazol-2-yl) 2-(5-chloranyl-6-methyl-1-benzofuran-3-yl)ethanethioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) 2-(5-chloranyl-6-methyl-1-benzofuran-3-yl)ethanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) 2-(5-chloro-6-methyl-benzofuran-3-yl)ethanethioate CAS Name: 2-(5-chloro-6-methyl-3-benzofuranyl)ethanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) 2-(5-chloro-6-methyl-1-benzofuran-3-yl)ethanethioate Traditional Name: 2-(5-chloro-6-methyl-benzofuran-3-yl)ethanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C18H12ClNO2S2 MolecularWeight: 373.87638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC=C2CC(=O)SC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC=C2CC(=O)SC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C18H12ClNO2S2/c1-10-6-15-12(8-13(10)19)11(9-22-15)7-17(21)24-18-20-14-4-2-3-5-16(14)23-18/h2-6,8-9H,7H2,1H3