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(6S)-2-(2-azaniumylethylsulfanyl)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate

(6S)-2-(2-azaniumylethylsulfanyl)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate

Systemtic Name:(6S)-2-(2-azaniumylethylsulfanyl)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate
Openeye Name:(6S)-2-(2-azaniumylethylsulfanyl)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate
CAS Name:(6S)-2-(2-ammonioethylthio)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate
IUPAC Name:(6S)-2-(2-azaniumylethylsulfanyl)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate
Traditional Name:(6S)-2-(2-ammonioethylthio)-6-methyl-5,6,7,8-tetrahydroquinazolin-4-olate
Formula: C11H17N3OS
MolecularWeight: 239.33718
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=NC(=N2)SCC[NH3+])[O-]


Isomeric SMILES

C[C@H]1CCC2=C(C1)C(=NC(=N2)SCC[NH3+])[O-]


InChI

InChI=1S/C11H17N3OS/c1-7-2-3-9-8(6-7)10(15)14-11(13-9)16-5-4-12/h7H,2-6,12H2,1H3,(H,13,14,15)/t7-/m0/s1


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