2-(4-acetamidophenyl)sulfanyl-N-(1,3-benzothiazol-2-yl)-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-(1,3-benzothiazol-2-yl)-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-(1,3-benzothiazol-2-yl)-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-(1,3-benzothiazol-2-yl)-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-(1,3-benzothiazol-2-yl)-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-(1,3-benzothiazol-2-yl)-N-(tetrahydrofurfuryl)acetamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O3S2/c1-15(26)23-16-8-10-18(11-9-16)29-14-21(27)25(13-17-5-4-12-28-17)22-24-19-6-2-3-7-20(19)30-22/h2-3,6-11,17H,4-5,12-14H2,1H3,(H,23,26)