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

Systemtic Name: 2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-6-propan-2-yl-pyrimidine-4-carbonitrile Openeye Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]-6-isopropyl-pyrimidine-4-carbonitrile CAS Name: 2-[[(3S)-1,1-dioxo-3-thiolanyl]-methylamino]-6-propan-2-yl-4-pyrimidinecarbonitrile IUPAC Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]-6-propan-2-ylpyrimidine-4-carbonitrile Traditional Name: 2-[[(3S)-1,1-diketothiolan-3-yl]-methyl-amino]-6-isopropyl-pyrimidine-4-carbonitrile Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C#N)N(C)C2CCS(=O)(=O)C2

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C#N)N(C)[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C13H18N4O2S/c1-9(2)12-6-10(7-14)15-13(16-12)17(3)11-4-5-20(18,19)8-11/h6,9,11H,4-5,8H2,1-3H3/t11-/m0/s1