6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-allylimino-3-(1,3-benzodioxol-5-ylmethyleneamino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-prop-2-enylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-allylimino-3-(piperonylideneamino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C=CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18N4O4S/c1-2-7-23-22-26(24-10-14-3-5-19-20(8-14)30-13-29-19)17(12-31-22)15-4-6-18-16(9-15)25-21(27)11-28-18/h2-6,8-10,12H,1,7,11,13H2,(H,25,27)