2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-N,N-dimethyl-pyridine-3-carboxamide

Systemtic Name: 2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-N,N-dimethyl-pyridine-3-carboxamide Openeye Name: 2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-N,N-dimethyl-pyridine-3-carboxamide CAS Name: 2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylthio]-N,N-dimethyl-3-pyridinecarboxamide IUPAC Name: 2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-N,N-dimethylpyridine-3-carboxamide Traditional Name: 2-[3-[4-(2-methoxyphenyl)piperazino]propylthio]-N,N-dimethyl-nicotinamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C(N=CC=C1)SCCCN2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CN(C)C(=O)C1=C(N=CC=C1)SCCCN2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H30N4O2S/c1-24(2)22(27)18-8-6-11-23-21(18)29-17-7-12-25-13-15-26(16-14-25)19-9-4-5-10-20(19)28-3/h4-6,8-11H,7,12-17H2,1-3H3