ethyl 2-(5,6-dimethyl-2-quinoxalin-6-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(5,6-dimethyl-2-quinoxalin-6-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-[5,6-dimethyl-2-(quinoxaline-6-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[5,6-dimethyl-2-[oxo(6-quinoxalinyl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5,6-dimethyl-2-(quinoxaline-6-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[5,6-dimethyl-2-(quinoxaline-6-carbonylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C(=C2)C)C)SC1=NC(=O)C3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C(=C2)C)C)SC1=NC(=O)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C22H20N4O3S/c1-4-29-20(27)12-26-18-9-13(2)14(3)10-19(18)30-22(26)25-21(28)15-5-6-16-17(11-15)24-8-7-23-16/h5-11H,4,12H2,1-3H3