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

Systemtic Name: 2-[(4-ethoxyphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[(4-ethoxyphenyl)carbamothioylamino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(4-ethoxyphenyl)carbamothioylamino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-(p-phenetylthiocarbamoylamino)ethyl]ammonium Formula: C17H30N3OS+ MolecularWeight: 324.5046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCC[NH+](C(C)C)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C17H29N3OS/c1-6-21-16-9-7-15(8-10-16)19-17(22)18-11-12-20(13(2)3)14(4)5/h7-10,13-14H,6,11-12H2,1-5H3,(H2,18,19,22)/p+1