N-[2-(N-butyl-C-phenyl-carbonimidoyl)-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl]-4-nitro-benzamide

Systemtic Name: N-[2-(N-butyl-C-phenyl-carbonimidoyl)-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl]-4-nitro-benzamide Openeye Name: N-[2-(N-butyl-C-phenyl-carbonimidoyl)-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl]-4-nitro-benzamide CAS Name: N-[2-[butylimino(phenyl)methyl]-4,6-dimethyl-3-thieno[2,3-b]pyridinyl]-4-nitrobenzamide IUPAC Name: N-[2-(N-butyl-C-phenylcarbonimidoyl)-4,6-dimethylthieno[2,3-b]pyridin-3-yl]-4-nitrobenzamide Traditional Name: N-[2-(N-butyl-C-phenyl-carbonimidoyl)-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl]-4-nitro-benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(C1=CC=CC=C1)C2=C(C3=C(S2)N=C(C=C3C)C)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN=C(C1=CC=CC=C1)C2=C(C3=C(S2)N=C(C=C3C)C)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O3S/c1-4-5-15-28-23(19-9-7-6-8-10-19)25-24(22-17(2)16-18(3)29-27(22)35-25)30-26(32)20-11-13-21(14-12-20)31(33)34/h6-14,16H,4-5,15H2,1-3H3,(H,30,32)