dimethyl-[2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethyl]azanium Openeye Name: dimethyl-[2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethyl]ammonium CAS Name: dimethyl-[2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)thio]ethyl]ammonium IUPAC Name: dimethyl-[2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethyl]azanium Traditional Name: dimethyl-[2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)thio]ethyl]ammonium Formula: C17H22N3S+ MolecularWeight: 300.44168

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCSC1=NC(=NC2=C1CCC2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCSC1=NC(=NC2=C1CCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3S/c1-20(2)11-12-21-17-14-9-6-10-15(14)18-16(19-17)13-7-4-3-5-8-13/h3-5,7-8H,6,9-12H2,1-2H3/p+1