N-[4-[(2R)-butan-2-yl]phenyl]-4-propyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-[4-[(2R)-butan-2-yl]phenyl]-4-propyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-[4-[(1R)-1-methylpropyl]phenyl]-4-propyl-piperazin-4-ium-1-carbothioamide CAS Name: N-[4-[(2R)-butan-2-yl]phenyl]-4-propyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-[4-[(2R)-butan-2-yl]phenyl]-4-propylpiperazin-4-ium-1-carbothioamide Traditional Name: N-[4-[(1R)-1-methylpropyl]phenyl]-4-propyl-piperazin-4-ium-1-carbothioamide Formula: C18H30N3S+ MolecularWeight: 320.5159

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=S)NC2=CC=C(C=C2)C(C)CC

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=S)NC2=CC=C(C=C2)[C@H](C)CC

InChI

InChI=1S/C18H29N3S/c1-4-10-20-11-13-21(14-12-20)18(22)19-17-8-6-16(7-9-17)15(3)5-2/h6-9,15H,4-5,10-14H2,1-3H3,(H,19,22)/p+1/t15-/m1/s1