N-[4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[4-(5-bromo-2-pyridyl)piperazino]-4-keto-butyl]thiophene-3-carboxamide Formula: C18H21BrN4O2S MolecularWeight: 437.35394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C18H21BrN4O2S/c19-15-3-4-16(21-12-15)22-7-9-23(10-8-22)17(24)2-1-6-20-18(25)14-5-11-26-13-14/h3-5,11-13H,1-2,6-10H2,(H,20,25)