N-[4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(5-bromopyridin-2-yl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H19BrN4O2S/c22-16-5-8-19(23-14-16)25-9-11-26(12-10-25)21(28)15-3-6-17(7-4-15)24-20(27)18-2-1-13-29-18/h1-8,13-14H,9-12H2,(H,24,27)