N-[3-aminocarbonyl-4-(4-bromophenyl)thiophen-2-yl]-3-azanyl-6-butyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: N-[3-aminocarbonyl-4-(4-bromophenyl)thiophen-2-yl]-3-azanyl-6-butyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-[4-(4-bromophenyl)-3-carbamoyl-2-thienyl]-6-butyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-[4-(4-bromophenyl)-3-carbamoyl-2-thiophenyl]-6-butyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-[4-(4-bromophenyl)-3-carbamoylthiophen-2-yl]-6-butylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-[4-(4-bromophenyl)-3-carbamoyl-2-thienyl]-6-butyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C23H21BrN4O2S2 MolecularWeight: 529.47244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)N)N

Isomeric SMILES

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)Br)C(=O)N)N

InChI

InChI=1S/C23H21BrN4O2S2/c1-2-3-4-14-9-10-15-18(25)19(32-22(15)27-14)21(30)28-23-17(20(26)29)16(11-31-23)12-5-7-13(24)8-6-12/h5-11H,2-4,25H2,1H3,(H2,26,29)(H,28,30)