3-(1,3-benzodioxol-5-ylmethyl)-N-(3-ethoxyphenyl)-4-oxidanylidene-2-phenylimino-1,3-thiazinane-6-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-ethoxyphenyl)-4-oxidanylidene-2-phenylimino-1,3-thiazinane-6-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-ethoxyphenyl)-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-ethoxyphenyl)-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(3-ethoxyphenyl)-4-oxo-2-phenylimino-1,3-thiazinane-6-carboxamide Traditional Name: 4-keto-N-m-phenetyl-2-phenylimino-3-piperonyl-1,3-thiazinane-6-carboxamide Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C2CC(=O)N(C(=NC3=CC=CC=C3)S2)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H25N3O5S/c1-2-33-21-10-6-9-20(14-21)28-26(32)24-15-25(31)30(27(36-24)29-19-7-4-3-5-8-19)16-18-11-12-22-23(13-18)35-17-34-22/h3-14,24H,2,15-17H2,1H3,(H,28,32)