2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[(4-isobutyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholino-ethanone CAS Name: 2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone Traditional Name: 2-[(4-isobutyl-5-phenethyl-1,2,4-triazol-3-yl)thio]-1-morpholino-ethanone Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC(=O)N2CCOCC2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC(=O)N2CCOCC2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2S/c1-16(2)14-24-18(9-8-17-6-4-3-5-7-17)21-22-20(24)27-15-19(25)23-10-12-26-13-11-23/h3-7,16H,8-15H2,1-2H3