ethyl 2-[2-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(tetralin-6-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[oxo(5,6,7,8-tetrahydronaphthalen-2-yl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(5,6,7,8-tetrahydronaphthalene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(tetralin-6-carbonylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2SC1=NC(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2SC1=NC(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C22H22N2O3S/c1-2-27-20(25)14-24-18-9-5-6-10-19(18)28-22(24)23-21(26)17-12-11-15-7-3-4-8-16(15)13-17/h5-6,9-13H,2-4,7-8,14H2,1H3