N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-phenyl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-phenyl)-4-pyrazol-1-yl-benzamide Openeye Name: N-[2-morpholino-5-(1-piperidylsulfonyl)phenyl]-4-pyrazol-1-yl-benzamide CAS Name: N-[2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)phenyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-4-pyrazol-1-ylbenzamide Traditional Name: N-(2-morpholino-5-piperidinosulfonyl-phenyl)-4-pyrazol-1-yl-benzamide Formula: C25H29N5O4S MolecularWeight: 495.59386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)NC(=O)C4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)NC(=O)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C25H29N5O4S/c31-25(20-5-7-21(8-6-20)30-14-4-11-26-30)27-23-19-22(35(32,33)29-12-2-1-3-13-29)9-10-24(23)28-15-17-34-18-16-28/h4-11,14,19H,1-3,12-13,15-18H2,(H,27,31)