4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(oxolan-2-ylmethyl)-1,3-thiazol-2-amine

Systemtic Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(oxolan-2-ylmethyl)-1,3-thiazol-2-amine Openeye Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(tetrahydrofuran-2-ylmethyl)thiazol-2-amine CAS Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-N-(2-oxolanylmethyl)-2-thiazolamine IUPAC Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-N-(oxolan-2-ylmethyl)-1,3-thiazol-2-amine Traditional Name: [4-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)thiazol-2-yl]-(tetrahydrofurfuryl)amine Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)NCC5CCCO5

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)NCC5CCCO5

InChI

InChI=1S/C22H25N3O3S/c1-14-8-18(19-12-29-22(24-19)23-10-17-4-3-7-26-17)15(2)25(14)11-16-5-6-20-21(9-16)28-13-27-20/h5-6,8-9,12,17H,3-4,7,10-11,13H2,1-2H3,(H,23,24)