ethyl 2-[2-(1-benzofuran-2-ylcarbonylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(1-benzofuran-2-ylcarbonylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(benzofuran-2-carbonylimino)-6-isopropyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-benzofuranyl(oxo)methyl]imino-6-propan-2-yl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1-benzofuran-2-carbonylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(benzofuran-2-carbonylimino)-6-isopropyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H22N2O4S/c1-4-28-21(26)13-25-17-10-9-15(14(2)3)12-20(17)30-23(25)24-22(27)19-11-16-7-5-6-8-18(16)29-19/h5-12,14H,4,13H2,1-3H3