N-cyclohexyl-2-[(E)-(3-iodanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-cyclohexyl-2-[(E)-(3-iodanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(E)-(4-allyloxy-3-iodo-5-methoxy-phenyl)methyleneamino]-N-cyclohexyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-cyclohexyl-2-[(E)-(3-iodo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-cyclohexyl-2-[(E)-(3-iodo-5-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(E)-(4-allyloxy-3-iodo-5-methoxy-benzylidene)amino]-N-cyclohexyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H31IN2O3S MolecularWeight: 578.50541

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)NC4CCCCC4)I)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/C2=C(C3=C(S2)CCCC3)C(=O)NC4CCCCC4)I)OCC=C

InChI

InChI=1S/C26H31IN2O3S/c1-3-13-32-24-20(27)14-17(15-21(24)31-2)16-28-26-23(19-11-7-8-12-22(19)33-26)25(30)29-18-9-5-4-6-10-18/h3,14-16,18H,1,4-13H2,2H3,(H,29,30)/b28-16+