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

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(4-methyl-5-thieno[3,2-b]pyrrolyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylthieno[3,2-b]pyrrol-5-yl)methanone Formula: C25H26N3OS+ MolecularWeight: 416.55844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C1C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)SC=C2

Isomeric SMILES

CN1C2=C(C=C1C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)SC=C2

InChI

InChI=1S/C25H25N3OS/c1-26-21-12-17-30-23(21)18-22(26)25(29)28-15-13-27(14-16-28)24(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-12,17-18,24H,13-16H2,1H3/p+1