2-spiro[5,6,7,8-tetrahydro-1H-quinazolin-3-ium-4,1'-cyclohexane]-2-ylsulfanylethanamide iodide

Systemtic Name: 2-spiro[5,6,7,8-tetrahydro-1H-quinazolin-3-ium-4,1'-cyclohexane]-2-ylsulfanylethanamide iodide Openeye Name: 2-spiro[5,6,7,8-tetrahydro-1H-quinazolin-3-ium-4,1'-cyclohexane]-2-ylsulfanylacetamide iodide CAS Name: 2-(2-spiro[5,6,7,8-tetrahydro-1H-quinazolin-3-ium-4,1'-cyclohexane]ylthio)acetamide iodide IUPAC Name: 2-spiro[5,6,7,8-tetrahydro-1H-quinazolin-3-ium-4,1'-cyclohexane]-2-ylsulfanylacetamide iodide Traditional Name: 2-(spiro[5,6,7,8-tetrahydro-1H-quinazolin-3-ium-4,1'-cyclohexane]-2-ylthio)acetamide iodide Formula: C15H24IN3OS MolecularWeight: 421.34003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=C(CCCC3)NC(=[NH+]2)SCC(=O)N.[I-]

Isomeric SMILES

C1CCC2(CC1)C3=C(CCCC3)NC(=[NH+]2)SCC(=O)N.[I-]

InChI

InChI=1S/C15H23N3OS.HI/c16-13(19)10-20-14-17-12-7-3-2-6-11(12)15(18-14)8-4-1-5-9-15;/h1-10H2,(H2,16,19)(H,17,18);1H