(E)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-iodanylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-iodanylfuran-2-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(5-iodo-2-furyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-iodo-2-furanyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(5-iodofuran-2-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(5-iodo-2-furyl)acrylamide Formula: C17H12IN3O2S MolecularWeight: 449.26555

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=CC3=CC=C(O3)I)C#N)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)/C(=C/C3=CC=C(O3)I)/C#N)C#N

InChI

InChI=1S/C17H12IN3O2S/c18-15-6-5-11(23-15)7-10(8-19)16(22)21-17-13(9-20)12-3-1-2-4-14(12)24-17/h5-7H,1-4H2,(H,21,22)/b10-7+