2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-6-cyclopropyl-pyrimidine-4-carbonitrile

Systemtic Name: 2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-6-cyclopropyl-pyrimidine-4-carbonitrile Openeye Name: 6-cyclopropyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]pyrimidine-4-carbonitrile CAS Name: 6-cyclopropyl-2-[[(3S)-1,1-dioxo-3-thiolanyl]-methylamino]-4-pyrimidinecarbonitrile IUPAC Name: 6-cyclopropyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]pyrimidine-4-carbonitrile Traditional Name: 6-cyclopropyl-2-[[(3S)-1,1-diketothiolan-3-yl]-methyl-amino]pyrimidine-4-carbonitrile Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C2=NC(=CC(=N2)C3CC3)C#N

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C2=NC(=CC(=N2)C3CC3)C#N

InChI

InChI=1S/C13H16N4O2S/c1-17(11-4-5-20(18,19)8-11)13-15-10(7-14)6-12(16-13)9-2-3-9/h6,9,11H,2-5,8H2,1H3/t11-/m0/s1