[4-(diphenylmethyl)piperazin-4-ium-1-yl]-(5-methylthiophen-2-yl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(5-methylthiophen-2-yl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(5-methyl-2-thienyl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(5-methyl-2-thiophenyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(5-methylthiophen-2-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(5-methyl-2-thienyl)methanone Formula: C23H25N2OS+ MolecularWeight: 377.5224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(S1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

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