(E)-azanyl-carbamothioyl-(1-pyridin-2-ylethylidene)azanium; 4-cyclohexylpiperazine-1-carbothioic S-acid

Systemtic Name: (E)-azanyl-carbamothioyl-(1-pyridin-2-ylethylidene)azanium; 4-cyclohexylpiperazine-1-carbothioic S-acid Openeye Name: (E)-amino-carbamothioyl-[1-(2-pyridyl)ethylidene]ammonium; 4-cyclohexylpiperazine-1-carbothioic S-acid CAS Name: (E)-amino-carbamothioyl-[1-(2-pyridinyl)ethylidene]ammonium; 4-cyclohexyl-1-piperazinecarbothioic S-acid IUPAC Name: (E)-amino-carbamothioyl-(1-pyridin-2-ylethylidene)azanium; 4-cyclohexylpiperazine-1-carbothioic S-acid Traditional Name: (E)-amino-[1-(2-pyridyl)ethylidene]-thiocarbamoyl-ammonium; 4-cyclohexylpiperazine-1-carbothioic S-acid Formula: C19H31N6OS2+ MolecularWeight: 423.61904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[N+](C(=S)N)N)C1=CC=CC=N1.C1CCC(CC1)N2CCN(CC2)C(=O)S

Isomeric SMILES

C/C(=[N+](/C(=S)N)\N)/C1=CC=CC=N1.C1CCC(CC1)N2CCN(CC2)C(=O)S

InChI

InChI=1S/C11H20N2OS.C8H10N4S/c14-11(15)13-8-6-12(7-9-13)10-4-2-1-3-5-10;1-6(12(10)8(9)13)7-4-2-3-5-11-7/h10H,1-9H2,(H,14,15);2-5H,1H3,(H3-,9,10,11,13)/p+1