N-[(1S,2S)-1-(4-phenylpiperazin-1-yl)-1-thiophen-2-yl-propan-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[(1S,2S)-1-(4-phenylpiperazin-1-yl)-1-thiophen-2-yl-propan-2-yl]pyridine-4-carboxamide Openeye Name: N-[(1S,2S)-1-methyl-2-(4-phenylpiperazin-1-yl)-2-(2-thienyl)ethyl]pyridine-4-carboxamide CAS Name: N-[(1S,2S)-1-(4-phenyl-1-piperazinyl)-1-thiophen-2-ylpropan-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[(1S,2S)-1-(4-phenylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]pyridine-4-carboxamide Traditional Name: N-[(1S,2S)-1-methyl-2-(4-phenylpiperazino)-2-(2-thienyl)ethyl]isonicotinamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)N2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C[C@@H]([C@@H](C1=CC=CS1)N2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H26N4OS/c1-18(25-23(28)19-9-11-24-12-10-19)22(21-8-5-17-29-21)27-15-13-26(14-16-27)20-6-3-2-4-7-20/h2-12,17-18,22H,13-16H2,1H3,(H,25,28)/t18-,22-/m0/s1