(E)-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-3-thiophen-3-yl-prop-2-en-1-amine

Systemtic Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-3-thiophen-3-yl-prop-2-en-1-amine Openeye Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-3-(3-thienyl)prop-2-en-1-amine CAS Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-3-(3-thiophenyl)-2-propen-1-amine IUPAC Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-3-thiophen-3-ylprop-2-en-1-amine Traditional Name: (3-butyl-2-phenyl-imidazol-4-yl)methyl-piperonyl-[(E)-3-(3-thienyl)allyl]amine Formula: C29H31N3O2S MolecularWeight: 485.64034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC=CC3=CSC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(C/C=C/C3=CSC=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H31N3O2S/c1-2-3-15-32-26(18-30-29(32)25-9-5-4-6-10-25)20-31(14-7-8-23-13-16-35-21-23)19-24-11-12-27-28(17-24)34-22-33-27/h4-13,16-18,21H,2-3,14-15,19-20,22H2,1H3/b8-7+