N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-chloranyl-2-propylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-chloranyl-2-propylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(1,1-dioxothiolan-3-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(1,1-dioxo-3-thiolanyl)-2-propylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(1,1-dioxothiolan-3-yl)-2-propylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(1,1-diketothiolan-3-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide Formula: C12H16ClN3O5S2 MolecularWeight: 381.85554

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2CCS(=O)(=O)C2)Cl

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2CCS(=O)(=O)C2)Cl

InChI

InChI=1S/C12H16ClN3O5S2/c1-2-4-23(20,21)12-14-6-9(13)10(16-12)11(17)15-8-3-5-22(18,19)7-8/h6,8H,2-5,7H2,1H3,(H,15,17)