N-[4-[3-(1,3-benzodioxol-5-ylmethyl)-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-phenyl-butanamide

Systemtic Name: N-[4-[3-(1,3-benzodioxol-5-ylmethyl)-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-phenyl-butanamide Openeye Name: N-[4-[3-(1,3-benzodioxol-5-ylmethyl)-2-oxo-hexahydropyrimidin-1-yl]phenyl]-2-phenyl-butanamide CAS Name: N-[4-[3-(1,3-benzodioxol-5-ylmethyl)-2-oxo-1,3-diazinan-1-yl]phenyl]-2-phenylbutanamide IUPAC Name: N-[4-[3-(1,3-benzodioxol-5-ylmethyl)-2-oxo-1,3-diazinan-1-yl]phenyl]-2-phenylbutanamide Traditional Name: N-[4-(2-keto-3-piperonyl-hexahydropyrimidin-1-yl)phenyl]-2-phenyl-butyramide Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H29N3O4/c1-2-24(21-7-4-3-5-8-21)27(32)29-22-10-12-23(13-11-22)31-16-6-15-30(28(31)33)18-20-9-14-25-26(17-20)35-19-34-25/h3-5,7-14,17,24H,2,6,15-16,18-19H2,1H3,(H,29,32)