N-(3-cyano-5-methyl-4-phenyl-thiophen-2-yl)-3-iodanyl-benzamide

Systemtic Name: N-(3-cyano-5-methyl-4-phenyl-thiophen-2-yl)-3-iodanyl-benzamide Openeye Name: N-(3-cyano-5-methyl-4-phenyl-2-thienyl)-3-iodo-benzamide CAS Name: N-(3-cyano-5-methyl-4-phenyl-2-thiophenyl)-3-iodobenzamide IUPAC Name: N-(3-cyano-5-methyl-4-phenylthiophen-2-yl)-3-iodobenzamide Traditional Name: N-(3-cyano-5-methyl-4-phenyl-2-thienyl)-3-iodo-benzamide Formula: C19H13IN2OS MolecularWeight: 444.28879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)I)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)I)C#N)C3=CC=CC=C3

InChI

InChI=1S/C19H13IN2OS/c1-12-17(13-6-3-2-4-7-13)16(11-21)19(24-12)22-18(23)14-8-5-9-15(20)10-14/h2-10H,1H3,(H,22,23)