N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-bromanyl-furan-2-carboxamide

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-bromanyl-furan-2-carboxamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-5-bromo-furan-2-carboxamide CAS Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-bromo-2-furancarboxamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-bromofuran-2-carboxamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-5-bromo-2-furamide Formula: C20H16BrN3O2S MolecularWeight: 442.32894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)Br)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)Br)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C20H16BrN3O2S/c21-16-10-9-14(26-16)19(25)24-20-17(11-5-1-4-8-15(11)27-20)18-22-12-6-2-3-7-13(12)23-18/h2-3,6-7,9-10H,1,4-5,8H2,(H,22,23)(H,24,25)