N-(4-pyrrolidin-1-ylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-pyrrolidin-1-ylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-pyrrolidin-1-ylphenyl)-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[4-(1-pyrrolidinyl)phenyl]-2-[4-(2-thiazolyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-pyrrolidin-1-ylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-pyrrolidinophenyl)-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C19H26N5OS+ MolecularWeight: 372.50764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=NC=CS4

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=NC=CS4

InChI

InChI=1S/C19H25N5OS/c25-18(15-22-10-12-24(13-11-22)19-20-7-14-26-19)21-16-3-5-17(6-4-16)23-8-1-2-9-23/h3-7,14H,1-2,8-13,15H2,(H,21,25)/p+1