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

Systemtic Name: methyl 2-[[6-(naphthalen-1-ylcarbonylamino)-1,3-benzothiazol-2-yl]sulfanyl]ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H16N2O3S2 MolecularWeight: 408.49334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N2O3S2/c1-26-19(24)12-27-21-23-17-10-9-14(11-18(17)28-21)22-20(25)16-8-4-6-13-5-2-3-7-15(13)16/h2-11H,12H2,1H3,(H,22,25)