5-bromanyl-N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-furan-2-carboxamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-5-bromo-furan-2-carboxamide CAS Name: 5-bromo-N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-5-bromofuran-2-carboxamide Traditional Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-5-bromo-2-furamide Formula: C23H22BrN3O2S MolecularWeight: 484.40868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC(=O)C4=CC=C(O4)Br

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC(=O)C4=CC=C(O4)Br

InChI

InChI=1S/C23H22BrN3O2S/c24-20-12-11-19(29-20)22(28)25-23(30)27-15-13-26(14-16-27)21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-12,21H,13-16H2,(H,25,28,30)