N-[4-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[4-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide Openeye Name: N-[4-[2-(3-bromoanilino)-2-oxo-ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide CAS Name: N-[4-[2-(3-bromoanilino)-2-oxoethyl]-2-thiazolyl]-4-(2-pyridinyl)-1-piperazinecarboxamide IUPAC Name: N-[4-[2-(3-bromoanilino)-2-oxoethyl]-1,3-thiazol-2-yl]-4-pyridin-2-ylpiperazine-1-carboxamide Traditional Name: N-[4-[2-(3-bromoanilino)-2-keto-ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide Formula: C21H21BrN6O2S MolecularWeight: 501.39944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)NC3=NC(=CS3)CC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)NC3=NC(=CS3)CC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H21BrN6O2S/c22-15-4-3-5-16(12-15)24-19(29)13-17-14-31-20(25-17)26-21(30)28-10-8-27(9-11-28)18-6-1-2-7-23-18/h1-7,12,14H,8-11,13H2,(H,24,29)(H,25,26,30)