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

Systemtic Name: 2-[(E)-(3-methoxy-2-prop-2-ynoxy-phenyl)methylideneamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(E)-(3-methoxy-2-prop-2-ynoxy-phenyl)methyleneamino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(E)-(3-methoxy-2-prop-2-ynoxyphenyl)methylideneamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(E)-(3-methoxy-2-prop-2-ynoxyphenyl)methylideneamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(E)-(3-methoxy-2-propargyloxy-benzylidene)amino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C26H24N2O3S MolecularWeight: 444.54536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC#C)C=NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OCC#C)/C=N/C2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O3S/c1-3-16-31-24-18(10-9-14-21(24)30-2)17-27-26-23(20-13-7-8-15-22(20)32-26)25(29)28-19-11-5-4-6-12-19/h1,4-6,9-12,14,17H,7-8,13,15-16H2,2H3,(H,28,29)/b27-17+