3-[1-[[(2-ethyl-1-benzofuran-3-yl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[1-[[(2-ethyl-1-benzofuran-3-yl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-[[(2-ethylbenzofuran-3-yl)methyl-methyl-amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-[[(2-ethyl-3-benzofuranyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-[[(2-ethyl-1-benzofuran-3-yl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[1-[[(2-ethylbenzofuran-3-yl)methyl-methyl-amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C19H25N5O2S MolecularWeight: 387.4991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)CN(C)CN3C(=S)N(C(=N3)CCC(=O)N)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)CN(C)CN3C(=S)N(C(=N3)CCC(=O)N)C

InChI

InChI=1S/C19H25N5O2S/c1-4-15-14(13-7-5-6-8-16(13)26-15)11-22(2)12-24-19(27)23(3)18(21-24)10-9-17(20)25/h5-8H,4,9-12H2,1-3H3,(H2,20,25)