N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)ethanamine

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)ethanamine Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)ethanamine CAS Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-[3-(1-imidazolyl)-1,2,4-thiadiazol-5-yl]ethanamine IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)ethanamine Traditional Name: 1-(3-imidazol-1-yl-1,2,4-thiadiazol-5-yl)ethyl-(2-piperonyloxyethyl)amine Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NS1)N2C=CN=C2)NCCOCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C1=NC(=NS1)N2C=CN=C2)NCCOCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H19N5O3S/c1-12(16-20-17(21-26-16)22-6-4-18-10-22)19-5-7-23-9-13-2-3-14-15(8-13)25-11-24-14/h2-4,6,8,10,12,19H,5,7,9,11H2,1H3