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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-tert-butylphenyl)methyl]-5-chloranyl-2-propylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-5-chloro-N-(1,1-dioxothiolan-3-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-5-chloro-N-(1,1-dioxo-3-thiolanyl)-2-propylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-5-chloro-N-(1,1-dioxothiolan-3-yl)-2-propylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-5-chloro-N-(1,1-diketothiolan-3-yl)-2-propylsulfonyl-pyrimidine-4-carboxamide Formula: C23H30ClN3O5S2 MolecularWeight: 528.0844

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)C(C)(C)C)C3CCS(=O)(=O)C3)Cl

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)C(C)(C)C)C3CCS(=O)(=O)C3)Cl

InChI

InChI=1S/C23H30ClN3O5S2/c1-5-11-34(31,32)22-25-13-19(24)20(26-22)21(28)27(18-10-12-33(29,30)15-18)14-16-6-8-17(9-7-16)23(2,3)4/h6-9,13,18H,5,10-12,14-15H2,1-4H3