N-(3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-bromophenyl)furan-2-carboxamide

Systemtic Name: N-(3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-bromophenyl)furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-furamide Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN2O3S/c1-11-2-7-14-17(10-11)28-21(18(14)19(23)25)24-20(26)16-9-8-15(27-16)12-3-5-13(22)6-4-12/h3-6,8-9,11H,2,7,10H2,1H3,(H2,23,25)(H,24,26)