N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-2,4-bis(oxidanylidene)-3-[(E)-3-phenylprop-2-enyl]quinazoline-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-2,4-bis(oxidanylidene)-3-[(E)-3-phenylprop-2-enyl]quinazoline-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-cinnamyl]-1-methyl-2,4-dioxo-quinazoline-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-2,4-dioxo-3-[(E)-3-phenylprop-2-enyl]-6-quinazolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-2,4-dioxo-3-[(E)-3-phenylprop-2-enyl]quinazoline-6-carboxamide Traditional Name: 3-[(E)-cinnamyl]-2,4-diketo-1-methyl-N-piperonyl-quinazoline-6-carboxamide Formula: C27H23N3O5 MolecularWeight: 469.48862

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)N(C1=O)CC=CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)N(C1=O)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O5/c1-29-22-11-10-20(25(31)28-16-19-9-12-23-24(14-19)35-17-34-23)15-21(22)26(32)30(27(29)33)13-5-8-18-6-3-2-4-7-18/h2-12,14-15H,13,16-17H2,1H3,(H,28,31)/b8-5+