dimethyl-[(3S)-3-[[[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]methyl]thiolan-3-yl]azanium

Systemtic Name: dimethyl-[(3S)-3-[[[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]methyl]thiolan-3-yl]azanium Openeye Name: dimethyl-[(3S)-3-[[[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]methyl]tetrahydrothiophen-3-yl]ammonium CAS Name: dimethyl-[(3S)-3-[[[4-(1-methyl-4-pyrazolyl)-2-pyrimidinyl]amino]methyl]-3-thiolanyl]ammonium IUPAC Name: dimethyl-[(3S)-3-[[[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]methyl]thiolan-3-yl]azanium Traditional Name: dimethyl-[(3S)-3-[[[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]methyl]tetrahydrothiophen-3-yl]ammonium Formula: C15H23N6S+ MolecularWeight: 319.44832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=NC=C2)NCC3(CCSC3)[NH+](C)C

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=NC=C2)NC[C@]3(CCSC3)[NH+](C)C

InChI

InChI=1S/C15H22N6S/c1-20(2)15(5-7-22-11-15)10-17-14-16-6-4-13(19-14)12-8-18-21(3)9-12/h4,6,8-9H,5,7,10-11H2,1-3H3,(H,16,17,19)/p+1/t15-/m0/s1