2-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamide Openeye Name: N-[[4-(morpholinomethyl)phenyl]methyl]-2-[1-(o-tolyl)tetrazol-5-yl]sulfanyl-acetamide CAS Name: 2-[[1-(2-methylphenyl)-5-tetrazolyl]thio]-N-[[4-(4-morpholinylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-[1-(2-methylphenyl)tetrazol-5-yl]sulfanyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide Traditional Name: N-[4-(morpholinomethyl)benzyl]-2-[[1-(o-tolyl)tetrazol-5-yl]thio]acetamide Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SCC(=O)NCC3=CC=C(C=C3)CN4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SCC(=O)NCC3=CC=C(C=C3)CN4CCOCC4

InChI

InChI=1S/C22H26N6O2S/c1-17-4-2-3-5-20(17)28-22(24-25-26-28)31-16-21(29)23-14-18-6-8-19(9-7-18)15-27-10-12-30-13-11-27/h2-9H,10-16H2,1H3,(H,23,29)