3-azanyl-6-(3-oxidanylidene-1,4-diazepan-1-yl)-4-propyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-6-(3-oxidanylidene-1,4-diazepan-1-yl)-4-propyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-6-(3-oxo-1,4-diazepan-1-yl)-4-propyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-6-(3-oxo-1,4-diazepan-1-yl)-4-propyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-6-(3-oxo-1,4-diazepan-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-6-(3-keto-1,4-diazepan-1-yl)-4-propyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)N3CCCNC(=O)C3

Isomeric SMILES

CCCC1=CC(=NC2=C1C(=C(S2)C(=O)N)N)N3CCCNC(=O)C3

InChI

InChI=1S/C16H21N5O2S/c1-2-4-9-7-10(21-6-3-5-19-11(22)8-21)20-16-12(9)13(17)14(24-16)15(18)23/h7H,2-6,8,17H2,1H3,(H2,18,23)(H,19,22)