N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-N-methyl-2-pyridin-3-yl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-N-methyl-2-pyridin-3-yl-1,3-thiazole-4-carboxamide Openeye Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-N-methyl-2-(3-pyridyl)thiazole-4-carboxamide CAS Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]-1-pyrrolidin-1-iumyl]-N-methyl-2-(3-pyridinyl)-4-thiazolecarboxamide IUPAC Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-N-methyl-2-pyridin-3-yl-1,3-thiazole-4-carboxamide Traditional Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-N-methyl-2-(3-pyridyl)thiazole-4-carboxamide Formula: C30H30N5O2S+ MolecularWeight: 524.6565

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CSC(=N1)C2=CN=CC=C2)[N+]3(CCCC3)CCCOC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CN(C(=O)C1=CSC(=N1)C2=CN=CC=C2)[N+]3(CCCC3)CCCOC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C30H30N5O2S/c1-34(30(36)28-22-38-29(33-28)26-6-4-15-32-21-26)35(16-2-3-17-35)18-5-19-37-27-13-11-25(12-14-27)24-9-7-23(20-31)8-10-24/h4,6-15,21-22H,2-3,5,16-19H2,1H3/q+1