N-[2-[3-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[3-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[3-[2-oxo-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[3-[[2-oxo-2-(phenethylamino)ethyl]thio]-1-indolyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[3-[2-oxo-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[3-[[2-keto-2-(phenethylamino)ethyl]thio]indol-1-yl]ethyl]thiophene-2-carboxamide Formula: C25H25N3O2S2 MolecularWeight: 463.6149

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C25H25N3O2S2/c29-24(26-13-12-19-7-2-1-3-8-19)18-32-23-17-28(21-10-5-4-9-20(21)23)15-14-27-25(30)22-11-6-16-31-22/h1-11,16-17H,12-15,18H2,(H,26,29)(H,27,30)