[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-[(2-ethylsulfanylpyrimidin-5-yl)methyl]azanium

Systemtic Name: [(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-[(2-ethylsulfanylpyrimidin-5-yl)methyl]azanium Openeye Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-[(2-ethylsulfanylpyrimidin-5-yl)methyl]ammonium CAS Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidinyl]-[[2-(ethylthio)-5-pyrimidinyl]methyl]ammonium IUPAC Name: [(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]-[(2-ethylsulfanylpyrimidin-5-yl)methyl]azanium Traditional Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-[[2-(ethylthio)pyrimidin-5-yl]methyl]ammonium Formula: C19H24N5S2+ MolecularWeight: 386.55736

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C=N1)C[NH2+]C2CCCN(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCSC1=NC=C(C=N1)C[NH2+][C@H]2CCCN(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H23N5S2/c1-2-25-18-21-11-14(12-22-18)10-20-15-6-5-9-24(13-15)19-23-16-7-3-4-8-17(16)26-19/h3-4,7-8,11-12,15,20H,2,5-6,9-10,13H2,1H3/p+1/t15-/m0/s1