N-[4-[3-(2-methylpropoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]phenyl]cyclobutanecarboxamide

Systemtic Name: N-[4-[3-(2-methylpropoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]phenyl]cyclobutanecarboxamide Openeye Name: N-[4-[3-isobutoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]phenyl]cyclobutanecarboxamide CAS Name: N-[4-[3-(2-methylpropoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[4-[3-(2-methylpropoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]phenyl]cyclobutanecarboxamide Traditional Name: N-[4-[3-isobutoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]phenyl]cyclobutanecarboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NN(C(=N1)C2=CC=CS2)C3=CC=C(C=C3)NC(=O)C4CCC4

Isomeric SMILES

CC(C)COC1=NN(C(=N1)C2=CC=CS2)C3=CC=C(C=C3)NC(=O)C4CCC4

InChI

InChI=1S/C21H24N4O2S/c1-14(2)13-27-21-23-19(18-7-4-12-28-18)25(24-21)17-10-8-16(9-11-17)22-20(26)15-5-3-6-15/h4,7-12,14-15H,3,5-6,13H2,1-2H3,(H,22,26)