N-(1-phenylethyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(1-phenylethyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide Openeye Name: N-(1-phenylethyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide CAS Name: N-(1-phenylethyl)-1-[3-(phenylthio)-2-pyrazinyl]-3-piperidinecarboxamide IUPAC Name: N-(1-phenylethyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-3-carboxamide Traditional Name: N-(1-phenylethyl)-1-[3-(phenylthio)pyrazin-2-yl]nipecotamide Formula: C24H26N4OS MolecularWeight: 418.55444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CCCN(C2)C3=NC=CN=C3SC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2CCCN(C2)C3=NC=CN=C3SC4=CC=CC=C4

InChI

InChI=1S/C24H26N4OS/c1-18(19-9-4-2-5-10-19)27-23(29)20-11-8-16-28(17-20)22-24(26-15-14-25-22)30-21-12-6-3-7-13-21/h2-7,9-10,12-15,18,20H,8,11,16-17H2,1H3,(H,27,29)