2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-methoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C21H29N5O4S2 MolecularWeight: 479.61606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CSC3=NNC(=N3)C4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CSC3=NNC(=N3)C4CCCC4

InChI

InChI=1S/C21H29N5O4S2/c1-30-18-10-9-16(32(28,29)26-11-5-2-6-12-26)13-17(18)22-19(27)14-31-21-23-20(24-25-21)15-7-3-4-8-15/h9-10,13,15H,2-8,11-12,14H2,1H3,(H,22,27)(H,23,24,25)