4-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[(4-isobutyl-5-morpholino-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[4-(2-methylpropyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[(4-isobutyl-5-morpholino-1,2,4-triazol-3-yl)thio]methyl]-N-phenyl-benzamide Formula: C24H29N5O2S MolecularWeight: 451.58436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C24H29N5O2S/c1-18(2)16-29-23(28-12-14-31-15-13-28)26-27-24(29)32-17-19-8-10-20(11-9-19)22(30)25-21-6-4-3-5-7-21/h3-11,18H,12-17H2,1-2H3,(H,25,30)