N-[(2S)-1-(4-methylsulfonylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[(2S)-1-(4-methylsulfonylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]pyridine-3-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]pyridine-3-carboxamide CAS Name: N-[(2S)-1-(4-methylsulfonyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[(2S)-1-(4-methylsulfonylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]pyridine-3-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-(4-mesylpiperazino)ethyl]nicotinamide Formula: C20H24N4O4S MolecularWeight: 416.49396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H24N4O4S/c1-29(27,28)24-12-10-23(11-13-24)20(26)18(14-16-6-3-2-4-7-16)22-19(25)17-8-5-9-21-15-17/h2-9,15,18H,10-14H2,1H3,(H,22,25)/t18-/m0/s1