N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide

Systemtic Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-[5-[(4-bromophenyl)methyl]thiazol-2-yl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-[5-[(4-bromophenyl)methyl]-2-thiazolyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: N-[5-(4-bromobenzyl)thiazol-2-yl]-4-keto-4-(3-phenyl-2-pyrazolin-1-yl)butyramide Formula: C23H21BrN4O2S MolecularWeight: 497.40744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H21BrN4O2S/c24-18-8-6-16(7-9-18)14-19-15-25-23(31-19)26-21(29)10-11-22(30)28-13-12-20(27-28)17-4-2-1-3-5-17/h1-9,15H,10-14H2,(H,25,26,29)