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

Systemtic Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-ethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1,3-benzodioxol-5-ylmethyleneamino)-2-ethylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-ethylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-ethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-ethylimino-3-(piperonylideneamino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O4S/c1-2-22-21-25(23-9-13-3-5-18-19(7-13)29-12-28-18)16(11-30-21)14-4-6-17-15(8-14)24-20(26)10-27-17/h3-9,11H,2,10,12H2,1H3,(H,24,26)