N-[(1S)-1-naphthalen-1-ylethyl]-6-(3-phenylpiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[(1S)-1-naphthalen-1-ylethyl]-6-(3-phenylpiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-[(1S)-1-(1-naphthyl)ethyl]-6-(3-phenylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-[(1S)-1-(1-naphthalenyl)ethyl]-6-(3-phenyl-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-[(1S)-1-naphthalen-1-ylethyl]-6-(3-phenylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-[(1S)-1-(1-naphthyl)ethyl]-6-(3-phenylpiperazino)nicotinamide Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CN=C(C=C3)N4CCNC(C4)C5=CC=CC=C5

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NC(=O)C3=CN=C(C=C3)N4CCNC(C4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O/c1-20(24-13-7-11-21-8-5-6-12-25(21)24)31-28(33)23-14-15-27(30-18-23)32-17-16-29-26(19-32)22-9-3-2-4-10-22/h2-15,18,20,26,29H,16-17,19H2,1H3,(H,31,33)/t20-,26?/m0/s1