3-azanyl-6-[4-(2-azanyl-4-oxidanyl-butanoyl)piperazin-1-yl]-4-propyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-6-[4-(2-azanyl-4-oxidanyl-butanoyl)piperazin-1-yl]-4-propyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-6-[4-(2-amino-4-hydroxy-butanoyl)piperazin-1-yl]-4-propyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-6-[4-(2-amino-4-hydroxy-1-oxobutyl)-1-piperazinyl]-4-propyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-6-[4-(2-amino-4-hydroxybutanoyl)piperazin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-6-[4-(2-amino-4-hydroxy-butanoyl)piperazino]-4-propyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C19H28N6O3S MolecularWeight: 420.52902

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)N3CCN(CC3)C(=O)C(CCO)N

Isomeric SMILES

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)N3CCN(CC3)C(=O)C(CCO)N

InChI

InChI=1S/C19H28N6O3S/c1-2-3-11-10-13(23-18-14(11)15(21)16(29-18)17(22)27)24-5-7-25(8-6-24)19(28)12(20)4-9-26/h10,12,26H,2-9,20-21H2,1H3,(H2,22,27)