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

Systemtic Name: 3-[1-[[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-[[(5-chloro-2-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-[[(5-chloro-2-methoxyphenyl)methyl-methylamino]methyl]-4-ethyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-[[(5-chloro-2-methoxyphenyl)methyl-methylamino]methyl]-4-ethyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[1-[[(5-chloro-2-methoxy-benzyl)-methyl-amino]methyl]-4-ethyl-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C17H24ClN5O2S MolecularWeight: 397.92276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)CC2=C(C=CC(=C2)Cl)OC)CCC(=O)N

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)CC2=C(C=CC(=C2)Cl)OC)CCC(=O)N

InChI

InChI=1S/C17H24ClN5O2S/c1-4-22-16(8-7-15(19)24)20-23(17(22)26)11-21(2)10-12-9-13(18)5-6-14(12)25-3/h5-6,9H,4,7-8,10-11H2,1-3H3,(H2,19,24)