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

Systemtic Name: 2-[(phenylmethyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-(benzylcarbamothioylamino)ethyl-diisopropyl-ammonium CAS Name: 2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-(benzylcarbamothioylamino)ethyl-di(propan-2-yl)azanium Traditional Name: 2-(benzylthiocarbamoylamino)ethyl-diisopropyl-ammonium Formula: C16H28N3S+ MolecularWeight: 294.47862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=S)NCC1=CC=CC=C1)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=S)NCC1=CC=CC=C1)C(C)C

InChI

InChI=1S/C16H27N3S/c1-13(2)19(14(3)4)11-10-17-16(20)18-12-15-8-6-5-7-9-15/h5-9,13-14H,10-12H2,1-4H3,(H2,17,18,20)/p+1