ethyl 2-[[6-(naphthalen-1-ylcarbonylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[6-(naphthalen-1-ylcarbonylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[6-(naphthalene-1-carbonylamino)-1,3-benzothiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[6-[[1-naphthalenyl(oxo)methyl]amino]-1,3-benzothiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[6-(naphthalene-1-carbonylamino)-1,3-benzothiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[6-(1-naphthoylamino)-1,3-benzothiazol-2-yl]thio]acetic acid ethyl ester Formula: C22H18N2O3S2 MolecularWeight: 422.51992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H18N2O3S2/c1-2-27-20(25)13-28-22-24-18-11-10-15(12-19(18)29-22)23-21(26)17-9-5-7-14-6-3-4-8-16(14)17/h3-12H,2,13H2,1H3,(H,23,26)