6-[3-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)imino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)imino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3-methoxyphenyl)imino-3-piperonyl-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C26H21N3O5S MolecularWeight: 487.52704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

COC1=CC=CC(=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H21N3O5S/c1-31-19-4-2-3-18(11-19)27-26-29(12-16-5-7-23-24(9-16)34-15-33-23)21(14-35-26)17-6-8-22-20(10-17)28-25(30)13-32-22/h2-11,14H,12-13,15H2,1H3,(H,28,30)