[4-(diphenylmethyl)piperazin-4-ium-1-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(3-methyl-2-thienyl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(3-methylthiophen-2-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(3-methyl-2-thienyl)methanone Formula: C23H25N2OS+ MolecularWeight: 377.5224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H24N2OS/c1-18-12-17-27-22(18)23(26)25-15-13-24(14-16-25)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-12,17,21H,13-16H2,1H3/p+1