2-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-(2-methoxyethyl)ethanamide

Systemtic Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-(2-methoxyethyl)ethanamide Openeye Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-(2-methoxyethyl)acetamide CAS Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-(2-methoxyethyl)acetamide IUPAC Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-(2-methoxyethyl)acetamide Traditional Name: 2-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-keto-1,3-benzoxazol-3-yl]-N-(2-methoxyethyl)acetamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)OC1=O

Isomeric SMILES

COCCNC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)OC1=O

InChI

InChI=1S/C21H23N3O6S/c1-29-11-9-22-20(25)14-24-18-7-6-17(12-19(18)30-21(24)26)31(27,28)23-10-8-15-4-2-3-5-16(15)13-23/h2-7,12H,8-11,13-14H2,1H3,(H,22,25)