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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(3-bromophenyl)methyl]-5-chloranyl-2-ethylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-5-chloro-N-(1,1-dioxothiolan-3-yl)-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-5-chloro-N-(1,1-dioxo-3-thiolanyl)-2-ethylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-5-chloro-N-(1,1-dioxothiolan-3-yl)-2-ethylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(3-bromobenzyl)-5-chloro-N-(1,1-diketothiolan-3-yl)-2-esyl-pyrimidine-4-carboxamide Formula: C18H19BrClN3O5S2 MolecularWeight: 536.84756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrClN3O5S2/c1-2-30(27,28)18-21-9-15(20)16(22-18)17(24)23(14-6-7-29(25,26)11-14)10-12-4-3-5-13(19)8-12/h3-5,8-9,14H,2,6-7,10-11H2,1H3