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

Systemtic Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine Openeye Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-N-(2-methoxy-1-methyl-ethyl)thiazol-2-amine CAS Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-N-(1-methoxypropan-2-yl)-2-thiazolamine IUPAC Name: 4-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-N-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine Traditional Name: [4-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)thiazol-2-yl]-(2-methoxy-1-methyl-ethyl)amine Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S/c1-13(10-25-4)22-21-23-18(11-28-21)17-7-14(2)24(15(17)3)9-16-5-6-19-20(8-16)27-12-26-19/h5-8,11,13H,9-10,12H2,1-4H3,(H,22,23)