N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-isopropoxy-1,2,4-triazol-1-yl]phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]-2-phenylsulfanylacetamide Traditional Name: N-[4-[5-(1,3-benzodioxol-5-yl)-3-isopropoxy-1,2,4-triazol-1-yl]phenyl]-2-(phenylthio)acetamide Formula: C26H24N4O4S MolecularWeight: 488.55816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)NC(=O)CSC5=CC=CC=C5

Isomeric SMILES

CC(C)OC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)NC(=O)CSC5=CC=CC=C5

InChI

InChI=1S/C26H24N4O4S/c1-17(2)34-26-28-25(18-8-13-22-23(14-18)33-16-32-22)30(29-26)20-11-9-19(10-12-20)27-24(31)15-35-21-6-4-3-5-7-21/h3-14,17H,15-16H2,1-2H3,(H,27,31)