ethyl 2-[6-acetamido-2-(2-naphthalen-1-ylethanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-acetamido-2-(2-naphthalen-1-ylethanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-acetamido-2-[2-(1-naphthyl)acetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-[2-(1-naphthalenyl)-1-oxoethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-acetamido-2-(2-naphthalen-1-ylacetyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-acetamido-2-[2-(1-naphthyl)acetyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C25H23N3O4S MolecularWeight: 461.53282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)C)SC1=NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)C)SC1=NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H23N3O4S/c1-3-32-24(31)15-28-21-12-11-19(26-16(2)29)14-22(21)33-25(28)27-23(30)13-18-9-6-8-17-7-4-5-10-20(17)18/h4-12,14H,3,13,15H2,1-2H3,(H,26,29)