N-[3-(6-tert-butyl-7-chloranyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)phenyl]-3-methyl-2-tetradecylsulfonyl-butanamide

Systemtic Name: N-[3-(6-tert-butyl-7-chloranyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)phenyl]-3-methyl-2-tetradecylsulfonyl-butanamide Openeye Name: N-[3-(6-tert-butyl-7-chloro-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)phenyl]-3-methyl-2-tetradecylsulfonyl-butanamide CAS Name: N-[3-(6-tert-butyl-7-chloro-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)phenyl]-3-methyl-2-tetradecylsulfonylbutanamide IUPAC Name: N-[3-(6-tert-butyl-7-chloro-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)phenyl]-3-methyl-2-tetradecylsulfonylbutanamide Traditional Name: N-[3-(6-tert-butyl-7-chloro-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)phenyl]-3-methyl-2-myristylsulfonyl-butyramide Formula: C33H52ClN5O3S MolecularWeight: 634.31568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCS(=O)(=O)C(C(C)C)C(=O)NC1=CC=CC(=C1)C2=NN3C(=N2)C(=C(N3)C(C)(C)C)Cl

Isomeric SMILES

CCCCCCCCCCCCCCS(=O)(=O)C(C(C)C)C(=O)NC1=CC=CC(=C1)C2=NN3C(=N2)C(=C(N3)C(C)(C)C)Cl

InChI

InChI=1S/C33H52ClN5O3S/c1-7-8-9-10-11-12-13-14-15-16-17-18-22-43(41,42)28(24(2)3)32(40)35-26-21-19-20-25(23-26)30-36-31-27(34)29(33(4,5)6)37-39(31)38-30/h19-21,23-24,28,37H,7-18,22H2,1-6H3,(H,35,40)