N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(3-phenylmethoxypropylamino)propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(3-phenylmethoxypropylamino)propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(3-benzyloxypropylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-oxo-1-(3-phenylmethoxypropylamino)propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-oxo-1-(3-phenylmethoxypropylamino)propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(3-benzoxypropylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]thiophene-2-carboxamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)COCCCNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4

InChI

InChI=1S/C26H27N3O3S/c30-25(27-13-7-14-32-18-19-8-2-1-3-9-19)23(29-26(31)24-12-6-15-33-24)16-20-17-28-22-11-5-4-10-21(20)22/h1-6,8-12,15,17,23,28H,7,13-14,16,18H2,(H,27,30)(H,29,31)