N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]thiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]thiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]thiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-2-thiophenecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]thiophene-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]thiophene-2-carboxamide Formula: C26H26N2O4S MolecularWeight: 462.56064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CS5

InChI

InChI=1S/C26H26N2O4S/c29-25(27-19-10-5-2-6-11-19)24(18-8-3-1-4-9-18)28(26(30)23-12-7-15-33-23)20-13-14-21-22(16-20)32-17-31-21/h1,3-4,7-9,12-16,19,24H,2,5-6,10-11,17H2,(H,27,29)