3-[2-[2-(benzotriazol-1-yl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]-N-[3,4-bis(fluoranyl)phenyl]sulfonyl-propanamide

Systemtic Name: 3-[2-[2-(benzotriazol-1-yl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]-N-[3,4-bis(fluoranyl)phenyl]sulfonyl-propanamide Openeye Name: 3-[2-[2-(benzotriazol-1-yl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]-N-(3,4-difluorophenyl)sulfonyl-propanamide CAS Name: 3-[2-[2-(1-benzotriazolyl)ethoxy]-4-(1-pyrazolylmethyl)phenyl]-N-(3,4-difluorophenyl)sulfonylpropanamide IUPAC Name: 3-[2-[2-(benzotriazol-1-yl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]-N-(3,4-difluorophenyl)sulfonylpropanamide Traditional Name: 3-[2-[2-(benzotriazol-1-yl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]-N-(3,4-difluorophenyl)sulfonyl-propionamide Formula: C27H24F2N6O4S MolecularWeight: 566.579066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCC(=O)NS(=O)(=O)C5=CC(=C(C=C5)F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CCOC3=C(C=CC(=C3)CN4C=CC=N4)CCC(=O)NS(=O)(=O)C5=CC(=C(C=C5)F)F

InChI

InChI=1S/C27H24F2N6O4S/c28-22-10-9-21(17-23(22)29)40(37,38)32-27(36)11-8-20-7-6-19(18-34-13-3-12-30-34)16-26(20)39-15-14-35-25-5-2-1-4-24(25)31-33-35/h1-7,9-10,12-13,16-17H,8,11,14-15,18H2,(H,32,36)