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

Systemtic Name: 2-[(E)-(3-iodanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylideneamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(E)-(3-iodo-4-isopropoxy-5-methoxy-phenyl)methyleneamino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(E)-(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(E)-(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(E)-(3-iodo-4-isopropoxy-5-methoxy-benzylidene)amino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H27IN2O3S MolecularWeight: 574.47365

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1I)C=NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1I)/C=N/C2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4)OC

InChI

InChI=1S/C26H27IN2O3S/c1-16(2)32-24-20(27)13-17(14-21(24)31-3)15-28-26-23(19-11-7-8-12-22(19)33-26)25(30)29-18-9-5-4-6-10-18/h4-6,9-10,13-16H,7-8,11-12H2,1-3H3,(H,29,30)/b28-15+