2-(dibutylamino)-6-[methylsulfonyl(propyl)amino]-N-[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]pyridine-4-carboxamide

Systemtic Name: 2-(dibutylamino)-6-[methylsulfonyl(propyl)amino]-N-[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]pyridine-4-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-hydroxy-ethyl]-2-(dibutylamino)-6-[methylsulfonyl(propyl)amino]pyridine-4-carboxamide CAS Name: 2-(dibutylamino)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-6-[methylsulfonyl(propyl)amino]-4-pyridinecarboxamide IUPAC Name: 2-(dibutylamino)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-6-[methylsulfonyl(propyl)amino]pyridine-4-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-hydroxy-ethyl]-2-(dibutylamino)-6-[mesyl(propyl)amino]isonicotinamide Formula: C27H42N4O4S MolecularWeight: 518.71178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=NC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)CO)N(CCC)S(=O)(=O)C

Isomeric SMILES

CCCCN(CCCC)C1=NC(=CC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)CO)N(CCC)S(=O)(=O)C

InChI

InChI=1S/C27H42N4O4S/c1-5-8-16-30(17-9-6-2)25-19-23(20-26(29-25)31(15-7-3)36(4,34)35)27(33)28-24(21-32)18-22-13-11-10-12-14-22/h10-14,19-20,24,32H,5-9,15-18,21H2,1-4H3,(H,28,33)/t24-/m0/s1