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

Systemtic Name: N-[2-(diethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[2-(diethylamino)-5-(4-morpholinylsulfonyl)phenyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[2-(diethylamino)-5-morpholin-4-ylsulfonylphenyl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C25H31N5O4S/c1-3-28(4-2)24-11-10-22(35(32,33)30-14-16-34-17-15-30)18-23(24)27-25(31)21-8-6-20(7-9-21)19-29-13-5-12-26-29/h5-13,18H,3-4,14-17,19H2,1-2H3,(H,27,31)