N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide Openeye Name: N-[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiophenecarboxamide IUPAC Name: N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide Traditional Name: N-[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC4=C(C=C3)OCCO4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(C3=CC4=C(C=C3)OCCO4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H28N2O4S/c30-26(28-20-10-5-2-6-11-20)25(19-8-3-1-4-9-19)29(27(31)24-12-7-17-34-24)21-13-14-22-23(18-21)33-16-15-32-22/h1,3-4,7-9,12-14,17-18,20,25H,2,5-6,10-11,15-16H2,(H,28,30)