2-[[2-(dimethylaminomethyl)-1,3-benzoxazol-5-yl]sulfanyl]ethanamine

Systemtic Name: 2-[[2-(dimethylaminomethyl)-1,3-benzoxazol-5-yl]sulfanyl]ethanamine Openeye Name: 2-[[2-(dimethylaminomethyl)-1,3-benzoxazol-5-yl]sulfanyl]ethanamine CAS Name: 2-[[2-(dimethylaminomethyl)-1,3-benzoxazol-5-yl]thio]ethanamine IUPAC Name: 2-[[2-(dimethylaminomethyl)-1,3-benzoxazol-5-yl]sulfanyl]ethanamine Traditional Name: [5-(2-aminoethylthio)-1,3-benzoxazol-2-yl]methyl-dimethyl-amine Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=C(O1)C=CC(=C2)SCCN

Isomeric SMILES

CN(C)CC1=NC2=C(O1)C=CC(=C2)SCCN

InChI

InChI=1S/C12H17N3OS/c1-15(2)8-12-14-10-7-9(17-6-5-13)3-4-11(10)16-12/h3-4,7H,5-6,8,13H2,1-2H3