N-[2-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanylethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanylethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanylethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[4,5-bis(4-methoxyphenyl)-1-propyl-2-imidazolyl]thio]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4,5-bis(4-methoxyphenyl)-1-propylimidazol-2-yl]sulfanylethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]thio]ethyl]-piperonylamide Formula: C30H31N3O5S MolecularWeight: 545.64924

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCNC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CCCN1C(=C(N=C1SCCNC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C30H31N3O5S/c1-4-16-33-28(21-7-12-24(36-3)13-8-21)27(20-5-10-23(35-2)11-6-20)32-30(33)39-17-15-31-29(34)22-9-14-25-26(18-22)38-19-37-25/h5-14,18H,4,15-17,19H2,1-3H3,(H,31,34)