2-[3-azanyl-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[3-azanyl-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[3-amino-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-1-morpholino-ethanone CAS Name: 2-[3-amino-5-[(2-chlorophenyl)methylthio]-1,2,4-triazol-4-yl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[3-amino-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[3-amino-5-[(2-chlorobenzyl)thio]-1,2,4-triazol-4-yl]-1-morpholino-ethanone Formula: C15H18ClN5O2S MolecularWeight: 367.85372

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C(=NN=C2SCC3=CC=CC=C3Cl)N

Isomeric SMILES

C1COCCN1C(=O)CN2C(=NN=C2SCC3=CC=CC=C3Cl)N

InChI

InChI=1S/C15H18ClN5O2S/c16-12-4-2-1-3-11(12)10-24-15-19-18-14(17)21(15)9-13(22)20-5-7-23-8-6-20/h1-4H,5-10H2,(H2,17,18)