[(cyclohexylcarbamothioylamino)-(4-methylphenyl)methylidene]-(phenylmethyl)azanium

Systemtic Name: [(cyclohexylcarbamothioylamino)-(4-methylphenyl)methylidene]-(phenylmethyl)azanium Openeye Name: benzyl-[(cyclohexylcarbamothioylamino)-(p-tolyl)methylene]ammonium CAS Name: [[[(cyclohexylamino)-sulfanylidenemethyl]amino]-(4-methylphenyl)methylidene]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(cyclohexylcarbamothioylamino)-(4-methylphenyl)methylidene]azanium Traditional Name: benzyl-[(cyclohexylthiocarbamoylamino)-(p-tolyl)methylene]ammonium Formula: C22H28N3S+ MolecularWeight: 366.54282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=[NH+]CC2=CC=CC=C2)NC(=S)NC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=[NH+]CC2=CC=CC=C2)NC(=S)NC3CCCCC3

InChI

InChI=1S/C22H27N3S/c1-17-12-14-19(15-13-17)21(23-16-18-8-4-2-5-9-18)25-22(26)24-20-10-6-3-7-11-20/h2,4-5,8-9,12-15,20H,3,6-7,10-11,16H2,1H3,(H2,23,24,25,26)/p+1