3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxidanylidene-N-phenethyl-1,3-thiazinane-6-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxidanylidene-N-phenethyl-1,3-thiazinane-6-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxo-N-phenethyl-1,3-thiazinane-6-carboxamide CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxo-N-phenethyl-1,3-thiazinane-6-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxo-N-phenethyl-1,3-thiazinane-6-carboxamide Traditional Name: 4-keto-2-(4-methoxyphenyl)imino-N-phenethyl-3-piperonyl-1,3-thiazinane-6-carboxamide Formula: C28H27N3O5S MolecularWeight: 517.59608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NCCC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NCCC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H27N3O5S/c1-34-22-10-8-21(9-11-22)30-28-31(17-20-7-12-23-24(15-20)36-18-35-23)26(32)16-25(37-28)27(33)29-14-13-19-5-3-2-4-6-19/h2-12,15,25H,13-14,16-18H2,1H3,(H,29,33)