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

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(4-methyl-1,2,3-thiadiazol-5-yl)methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylthiadiazol-5-yl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(4-methyl-5-thiadiazolyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylthiadiazol-5-yl)methanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylthiadiazol-5-yl)methanone Formula: C21H23N4OS+ MolecularWeight: 379.49852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4OS/c1-16-20(27-23-22-16)21(26)25-14-12-24(13-15-25)19(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,19H,12-15H2,1H3/p+1