methyl 2-[2-(3-phenoxypropanoylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(3-phenoxypropanoylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-isopropyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-(1-oxo-3-phenoxypropyl)imino-6-propan-2-yl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-phenoxypropanoylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-isopropyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=NC(=O)CCOC3=CC=CC=C3)S2)CC(=O)OC

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=NC(=O)CCOC3=CC=CC=C3)S2)CC(=O)OC

InChI

InChI=1S/C22H24N2O4S/c1-15(2)16-9-10-18-19(13-16)29-22(24(18)14-21(26)27-3)23-20(25)11-12-28-17-7-5-4-6-8-17/h4-10,13,15H,11-12,14H2,1-3H3