3-[[4-(2-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 3-[[4-(2-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[5-morpholino-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[4-(2-methylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[4-(2-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[5-morpholino-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCCC(=O)N)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCCC(=O)N)N3CCOCC3

InChI

InChI=1S/C16H21N5O2S/c1-12-4-2-3-5-13(12)21-15(20-7-9-23-10-8-20)18-19-16(21)24-11-6-14(17)22/h2-5H,6-11H2,1H3,(H2,17,22)