N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-(piperonylamino)ethyl]thiophene-2-carboxamide Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CS5

InChI

InChI=1S/C24H21N3O4S/c28-23(26-12-15-7-8-20-21(10-15)31-14-30-20)19(27-24(29)22-6-3-9-32-22)11-16-13-25-18-5-2-1-4-17(16)18/h1-10,13,19,25H,11-12,14H2,(H,26,28)(H,27,29)