2-[(3-methylphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[(3-methylphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-(m-tolylcarbamothioylamino)ethyl]ammonium CAS Name: 2-[[(3-methylanilino)-sulfanylidenemethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(3-methylphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-(m-tolylthiocarbamoylamino)ethyl]ammonium Formula: C16H28N3S+ MolecularWeight: 294.47862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NCC[NH+](C(C)C)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C16H27N3S/c1-12(2)19(13(3)4)10-9-17-16(20)18-15-8-6-7-14(5)11-15/h6-8,11-13H,9-10H2,1-5H3,(H2,17,18,20)/p+1