N-[(1S)-2-(3-ethoxypropylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(1S)-2-(3-ethoxypropylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(1S)-2-(3-ethoxypropylamino)-2-oxo-1-phenyl-ethyl]-N-(2-thienylmethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[(1S)-2-(3-ethoxypropylamino)-2-oxo-1-phenylethyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(1S)-2-(3-ethoxypropylamino)-2-oxo-1-phenylethyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(1S)-2-(3-ethoxypropylamino)-2-keto-1-phenyl-ethyl]-N-(2-thenyl)-piperonylamide Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(C1=CC=CC=C1)N(CC2=CC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOCCCNC(=O)[C@H](C1=CC=CC=C1)N(CC2=CC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H28N2O5S/c1-2-31-14-7-13-27-25(29)24(19-8-4-3-5-9-19)28(17-21-10-6-15-34-21)26(30)20-11-12-22-23(16-20)33-18-32-22/h3-6,8-12,15-16,24H,2,7,13-14,17-18H2,1H3,(H,27,29)/t24-/m0/s1