N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(3-bromophenyl)methyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(3-bromophenyl)methyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-2-methyl-5-phenyl-thiazole-4-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-N-(1,1-dioxo-3-thiolanyl)-2-methyl-5-phenyl-4-thiazolecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide Traditional Name: N-(3-bromobenzyl)-N-(1,1-diketothiolan-3-yl)-2-methyl-5-phenyl-thiazole-4-carboxamide Formula: C22H21BrN2O3S2 MolecularWeight: 505.44774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C2=CC=CC=C2)C(=O)N(CC3=CC(=CC=C3)Br)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NC(=C(S1)C2=CC=CC=C2)C(=O)N(CC3=CC(=CC=C3)Br)C4CCS(=O)(=O)C4

InChI

InChI=1S/C22H21BrN2O3S2/c1-15-24-20(21(29-15)17-7-3-2-4-8-17)22(26)25(19-10-11-30(27,28)14-19)13-16-6-5-9-18(23)12-16/h2-9,12,19H,10-11,13-14H2,1H3