N-[(E)-[1-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-4-iodanyl-3-methoxy-benzamide

Systemtic Name: N-[(E)-[1-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-4-iodanyl-3-methoxy-benzamide Openeye Name: N-[(E)-[1-(3-cyano-4,5-dimethyl-2-thienyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-4-iodo-3-methoxy-benzamide CAS Name: N-[(E)-[1-(3-cyano-4,5-dimethyl-2-thiophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-4-iodo-3-methoxybenzamide IUPAC Name: N-[(E)-[1-(3-cyano-4,5-dimethylthiophen-2-yl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-4-iodo-3-methoxybenzamide Traditional Name: N-[(E)-[1-(3-cyano-4,5-dimethyl-2-thienyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-4-iodo-3-methoxy-benzamide Formula: C22H21IN4O2S MolecularWeight: 532.39721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)C=NNC(=O)C3=CC(=C(C=C3)I)OC

Isomeric SMILES

CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)/C=N/NC(=O)C3=CC(=C(C=C3)I)OC

InChI

InChI=1S/C22H21IN4O2S/c1-12-8-17(14(3)27(12)22-18(10-24)13(2)15(4)30-22)11-25-26-21(28)16-6-7-19(23)20(9-16)29-5/h6-9,11H,1-5H3,(H,26,28)/b25-11+