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

Systemtic Name: 2-(3-ethyl-7-methyl-quinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(3-ethyl-7-methyl-2-quinolyl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(3-ethyl-7-methyl-2-quinolinyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-ethyl-7-methylquinolin-2-yl)sulfanyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(3-ethyl-7-methyl-2-quinolyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=CC2=C1)C)SCC(=O)NC3=NC4=C(S3)CCCC4

Isomeric SMILES

CCC1=C(N=C2C=C(C=CC2=C1)C)SCC(=O)NC3=NC4=C(S3)CCCC4

InChI

InChI=1S/C21H23N3OS2/c1-3-14-11-15-9-8-13(2)10-17(15)22-20(14)26-12-19(25)24-21-23-16-6-4-5-7-18(16)27-21/h8-11H,3-7,12H2,1-2H3,(H,23,24,25)