N-(4-methoxyphenyl)-4-(phenylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(4-methoxyphenyl)-4-(phenylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-benzyl-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide CAS Name: N-(4-methoxyphenyl)-4-(phenylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-benzyl-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-benzyl-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide Formula: C19H24N3OS+ MolecularWeight: 342.47836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23N3OS/c1-23-18-9-7-17(8-10-18)20-19(24)22-13-11-21(12-14-22)15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3,(H,20,24)/p+1