2-[[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-morpholin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-morpholin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(5-chloro-2-methoxy-phenyl)methyl-methyl-amino]methyl]-4-ethyl-5-morpholino-1,2,4-triazole-3-thione CAS Name: 2-[[(5-chloro-2-methoxyphenyl)methyl-methylamino]methyl]-4-ethyl-5-(4-morpholinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[(5-chloro-2-methoxyphenyl)methyl-methylamino]methyl]-4-ethyl-5-morpholin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(5-chloro-2-methoxy-benzyl)-methyl-amino]methyl]-4-ethyl-5-morpholino-1,2,4-triazole-3-thione Formula: C18H26ClN5O2S MolecularWeight: 411.94934

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)CC2=C(C=CC(=C2)Cl)OC)N3CCOCC3

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)CC2=C(C=CC(=C2)Cl)OC)N3CCOCC3

InChI

InChI=1S/C18H26ClN5O2S/c1-4-23-17(22-7-9-26-10-8-22)20-24(18(23)27)13-21(2)12-14-11-15(19)5-6-16(14)25-3/h5-6,11H,4,7-10,12-13H2,1-3H3