N-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)sulfanyl-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)sulfanyl-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(o-tolylsulfanyl)-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(2-methylphenyl)thio]-N-(2-oxolanylmethyl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)sulfanyl-N-(oxolan-2-ylmethyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(o-tolylthio)-N-(tetrahydrofurfuryl)acetamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O2S2/c1-15-7-2-4-10-18(15)26-14-20(24)23(13-16-8-6-12-25-16)21-22-17-9-3-5-11-19(17)27-21/h2-5,7,9-11,16H,6,8,12-14H2,1H3