N-butyl-N-methyl-2-[[4-(3-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-butyl-N-methyl-2-[[4-(3-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-butyl-N-methyl-2-[[5-morpholino-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-butyl-N-methyl-2-[[4-(3-methylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-butyl-N-methyl-2-[[4-(3-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-butyl-N-methyl-2-[[5-morpholino-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CSC1=NN=C(N1C2=CC=CC(=C2)C)N3CCOCC3

Isomeric SMILES

CCCCN(C)C(=O)CSC1=NN=C(N1C2=CC=CC(=C2)C)N3CCOCC3

InChI

InChI=1S/C20H29N5O2S/c1-4-5-9-23(3)18(26)15-28-20-22-21-19(24-10-12-27-13-11-24)25(20)17-8-6-7-16(2)14-17/h6-8,14H,4-5,9-13,15H2,1-3H3