(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]azanium

Systemtic Name: (5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]azanium Openeye Name: (5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-[(1S)-1-methyl-2-oxo-2-piperazin-1-yl-ethyl]ammonium CAS Name: (5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-[(2S)-1-oxo-1-(1-piperazinyl)propan-2-yl]ammonium IUPAC Name: (5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-[(2S)-1-oxo-1-piperazin-1-ylpropan-2-yl]azanium Traditional Name: (5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-[(1S)-2-keto-1-methyl-2-piperazino-ethyl]ammonium Formula: C15H22N5OS+ MolecularWeight: 320.43308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)[NH2+]C(C)C(=O)N3CCNCC3)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)[NH2+][C@@H](C)C(=O)N3CCNCC3)C

InChI

InChI=1S/C15H21N5OS/c1-9-11(3)22-14-12(9)13(17-8-18-14)19-10(2)15(21)20-6-4-16-5-7-20/h8,10,16H,4-7H2,1-3H3,(H,17,18,19)/p+1/t10-/m0/s1