[4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]-(4-methyl-1,2,3-thiadiazol-5-yl)methanone

Systemtic Name: [4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]-(4-methyl-1,2,3-thiadiazol-5-yl)methanone Openeye Name: [4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]-(4-methylthiadiazol-5-yl)methanone CAS Name: [4-(2,2-diphenylethyl)-1-piperazin-4-iumyl]-(4-methyl-5-thiadiazolyl)methanone IUPAC Name: [4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]-(4-methylthiadiazol-5-yl)methanone Traditional Name: [4-(2,2-diphenylethyl)piperazin-4-ium-1-yl]-(4-methylthiadiazol-5-yl)methanone Formula: C22H25N4OS+ MolecularWeight: 393.5251

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)N2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SN=N1)C(=O)N2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4OS/c1-17-21(28-24-23-17)22(27)26-14-12-25(13-15-26)16-20(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,20H,12-16H2,1H3/p+1