6-[[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[4-[(2-methylthiazol-4-yl)methyl]piperazino]methyl]sesamol Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCN(CC2)CC3=CC4=C(C=C3O)OCO4

Isomeric SMILES

CC1=NC(=CS1)CN2CCN(CC2)CC3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C17H21N3O3S/c1-12-18-14(10-24-12)9-20-4-2-19(3-5-20)8-13-6-16-17(7-15(13)21)23-11-22-16/h6-7,10,21H,2-5,8-9,11H2,1H3