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

Systemtic Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-propan-2-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1,3-benzodioxol-5-ylmethyleneamino)-2-isopropylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-propan-2-ylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(1,3-benzodioxol-5-ylmethylideneamino)-2-propan-2-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-isopropylimino-3-(piperonylideneamino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O4S/c1-13(2)24-22-26(23-9-14-3-5-19-20(7-14)30-12-29-19)17(11-31-22)15-4-6-18-16(8-15)25-21(27)10-28-18/h3-9,11,13H,10,12H2,1-2H3,(H,25,27)