N-(phenylmethyl)-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(phenylmethyl)-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-benzyl-4-(2-thienylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(phenylmethyl)-4-(thiophen-2-ylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-benzyl-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-benzyl-4-(2-thenyl)piperazin-4-ium-1-carboxamide Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H21N3OS/c21-17(18-13-15-5-2-1-3-6-15)20-10-8-19(9-11-20)14-16-7-4-12-22-16/h1-7,12H,8-11,13-14H2,(H,18,21)/p+1