tert-butyl-[3-[(2-propan-2-ylphenyl)carbamothioylamino]propyl]azanium

Systemtic Name: tert-butyl-[3-[(2-propan-2-ylphenyl)carbamothioylamino]propyl]azanium Openeye Name: tert-butyl-[3-[(2-isopropylphenyl)carbamothioylamino]propyl]ammonium CAS Name: tert-butyl-[3-[[(2-propan-2-ylanilino)-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: tert-butyl-[3-[(2-propan-2-ylphenyl)carbamothioylamino]propyl]azanium Traditional Name: tert-butyl-[3-(o-cumenylthiocarbamoylamino)propyl]ammonium Formula: C17H30N3S+ MolecularWeight: 308.5052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NCCC[NH2+]C(C)(C)C

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NCCC[NH2+]C(C)(C)C

InChI

InChI=1S/C17H29N3S/c1-13(2)14-9-6-7-10-15(14)20-16(21)18-11-8-12-19-17(3,4)5/h6-7,9-10,13,19H,8,11-12H2,1-5H3,(H2,18,20,21)/p+1