5-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propan-2-yloxy-phenyl]-3-(phenylmethyl)-1-propyl-pyrazole-4-carboxamide

Systemtic Name: 5-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propan-2-yloxy-phenyl]-3-(phenylmethyl)-1-propyl-pyrazole-4-carboxamide Openeye Name: 3-benzyl-5-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-isopropoxy-phenyl]-1-propyl-pyrazole-4-carboxamide CAS Name: 5-[5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]-2-propan-2-yloxyphenyl]-3-(phenylmethyl)-1-propyl-4-pyrazolecarboxamide IUPAC Name: 3-benzyl-5-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propan-2-yloxyphenyl]-1-propylpyrazole-4-carboxamide Traditional Name: 3-benzyl-5-[5-[4-(2-hydroxyethyl)piperazino]sulfonyl-2-isopropoxy-phenyl]-1-propyl-pyrazole-4-carboxamide Formula: C29H39N5O5S MolecularWeight: 569.71546

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)CC2=CC=CC=C2)C(=O)N)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CCO)OC(C)C

Isomeric SMILES

CCCN1C(=C(C(=N1)CC2=CC=CC=C2)C(=O)N)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CCO)OC(C)C

InChI

InChI=1S/C29H39N5O5S/c1-4-12-34-28(27(29(30)36)25(31-34)19-22-8-6-5-7-9-22)24-20-23(10-11-26(24)39-21(2)3)40(37,38)33-15-13-32(14-16-33)17-18-35/h5-11,20-21,35H,4,12-19H2,1-3H3,(H2,30,36)