(4-methylthieno[3,2-b]pyrrol-5-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-methylthieno[3,2-b]pyrrol-5-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone CAS Name: (4-methyl-5-thieno[3,2-b]pyrrolyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C1C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)SC=C2

Isomeric SMILES

CN1C2=C(C=C1C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)SC=C2

InChI

InChI=1S/C19H21N3OS/c1-20-16-7-12-24-18(16)13-17(20)19(23)22-10-8-21(9-11-22)14-15-5-3-2-4-6-15/h2-7,12-13H,8-11,14H2,1H3/p+1