2-[(4-ethylphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[(4-ethylphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[(4-ethylphenyl)carbamothioylamino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(4-ethylanilino)-sulfanylidenemethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(4-ethylphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[(4-ethylphenyl)thiocarbamoylamino]ethyl-diisopropyl-ammonium Formula: C17H30N3S+ MolecularWeight: 308.5052

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NCC[NH+](C(C)C)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C17H29N3S/c1-6-15-7-9-16(10-8-15)19-17(21)18-11-12-20(13(2)3)14(4)5/h7-10,13-14H,6,11-12H2,1-5H3,(H2,18,19,21)/p+1