N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C26H33N5O3S/c1-3-29(4-2)25-14-13-23(35(33,34)31-17-6-5-7-18-31)19-24(25)28-26(32)22-11-9-21(10-12-22)20-30-16-8-15-27-30/h8-16,19H,3-7,17-18,20H2,1-2H3,(H,28,32)