N-[4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-5-thiophen-2-yl-pentanamide Openeye Name: N-[4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-5-(2-thienyl)pentanamide CAS Name: N-[4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-5-thiophen-2-ylpentanamide IUPAC Name: N-[4-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-5-thiophen-2-ylpentanamide Traditional Name: N-[4-[4-(5-esyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-5-(2-thienyl)valeramide Formula: C27H26N4O4S2 MolecularWeight: 534.64974

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3=C(NN=C3)C4=CC=C(C=C4)NC(=O)CCCCC5=CC=CS5

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3=C(NN=C3)C4=CC=C(C=C4)NC(=O)CCCCC5=CC=CS5

InChI

InChI=1S/C27H26N4O4S2/c1-2-37(33,34)21-13-14-24-23(16-21)30-27(35-24)22-17-28-31-26(22)18-9-11-19(12-10-18)29-25(32)8-4-3-6-20-7-5-15-36-20/h5,7,9-17H,2-4,6,8H2,1H3,(H,28,31)(H,29,32)