2-[[5-(1H-indazol-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[[5-(1H-indazol-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[[5-(1H-indazol-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[[5-(1H-indazol-3-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[[5-(1H-indazol-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[5-(1H-indazol-3-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(3-piperidinosulfonylphenyl)acetamide Formula: C28H27N7O3S2 MolecularWeight: 573.68908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=NNC6=CC=CC=C65

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=NNC6=CC=CC=C65

InChI

InChI=1S/C28H27N7O3S2/c36-25(29-20-10-9-13-22(18-20)40(37,38)34-16-7-2-8-17-34)19-39-28-33-32-27(35(28)21-11-3-1-4-12-21)26-23-14-5-6-15-24(23)30-31-26/h1,3-6,9-15,18H,2,7-8,16-17,19H2,(H,29,36)(H,30,31)