2-(3-ethylquinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(3-ethylquinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(3-ethyl-2-quinolyl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(3-ethyl-2-quinolinyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-ethylquinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(3-ethyl-2-quinolyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC=CC=C2N=C1SCC(=O)NC3=NC4=C(S3)CCCC4

Isomeric SMILES

CCC1=CC2=CC=CC=C2N=C1SCC(=O)NC3=NC4=C(S3)CCCC4

InChI

InChI=1S/C20H21N3OS2/c1-2-13-11-14-7-3-4-8-15(14)21-19(13)25-12-18(24)23-20-22-16-9-5-6-10-17(16)26-20/h3-4,7-8,11H,2,5-6,9-10,12H2,1H3,(H,22,23,24)