N-[4-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[4-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[4-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)thiazol-2-yl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[4-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)-2-thiazolyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[4-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[4-(3-keto-4-propyl-1,4-benzoxazin-6-yl)thiazol-2-yl]-1,3-benzodioxole-5-sulfonamide Formula: C21H19N3O6S2 MolecularWeight: 473.52206

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=C(C=C2)C3=CSC(=N3)NS(=O)(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCN1C(=O)COC2=C1C=C(C=C2)C3=CSC(=N3)NS(=O)(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O6S2/c1-2-7-24-16-8-13(3-5-17(16)28-10-20(24)25)15-11-31-21(22-15)23-32(26,27)14-4-6-18-19(9-14)30-12-29-18/h3-6,8-9,11H,2,7,10,12H2,1H3,(H,22,23)