3-[5-[[3-ethoxy-4-(naphthalen-1-ylmethoxy)-5-prop-2-enyl-phenyl]methylidene]-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid

Systemtic Name: 3-[5-[[3-ethoxy-4-(naphthalen-1-ylmethoxy)-5-prop-2-enyl-phenyl]methylidene]-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid Openeye Name: 3-[5-[[3-allyl-5-ethoxy-4-(1-naphthylmethoxy)phenyl]methylene]-4,6-dioxo-2-thioxo-hexahydropyrimidin-1-yl]benzoic acid CAS Name: 3-[5-[[3-ethoxy-4-(1-naphthalenylmethoxy)-5-prop-2-enylphenyl]methylidene]-4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid IUPAC Name: 3-[5-[[3-ethoxy-4-(naphthalen-1-ylmethoxy)-5-prop-2-enylphenyl]methylidene]-4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid Traditional Name: 3-[5-[3-allyl-5-ethoxy-4-(1-naphthylmethoxy)benzylidene]-4,6-diketo-2-thioxo-hexahydropyrimidin-1-yl]benzoic acid Formula: C34H28N2O6S MolecularWeight: 592.66092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=CC3=CC=CC=C32)CC=C)C=C4C(=O)NC(=S)N(C4=O)C5=CC=CC(=C5)C(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=CC3=CC=CC=C32)CC=C)C=C4C(=O)NC(=S)N(C4=O)C5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C34H28N2O6S/c1-3-9-23-16-21(17-28-31(37)35-34(43)36(32(28)38)26-14-8-12-24(19-26)33(39)40)18-29(41-4-2)30(23)42-20-25-13-7-11-22-10-5-6-15-27(22)25/h3,5-8,10-19H,1,4,9,20H2,2H3,(H,39,40)(H,35,37,43)