3-azanyl-6-butyl-N-(4-chloranyl-3-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-6-butyl-N-(4-chloranyl-3-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-6-butyl-N-(4-chloro-3-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-6-butyl-N-(4-chloro-3-nitrophenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-6-butyl-N-(4-chloro-3-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-6-butyl-N-(4-chloro-3-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])N

Isomeric SMILES

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C18H17ClN4O3S/c1-2-3-4-10-5-7-12-15(20)16(27-18(12)22-10)17(24)21-11-6-8-13(19)14(9-11)23(25)26/h5-9H,2-4,20H2,1H3,(H,21,24)