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

Systemtic Name: N-[2-[3-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide Openeye Name: N-[2-[3-[2-oxo-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide CAS Name: N-[2-[3-[[2-oxo-2-(phenethylamino)ethyl]thio]-1-indolyl]ethyl]benzamide IUPAC Name: N-[2-[3-[2-oxo-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide Traditional Name: N-[2-[3-[[2-keto-2-(phenethylamino)ethyl]thio]indol-1-yl]ethyl]benzamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O2S/c31-26(28-16-15-21-9-3-1-4-10-21)20-33-25-19-30(24-14-8-7-13-23(24)25)18-17-29-27(32)22-11-5-2-6-12-22/h1-14,19H,15-18,20H2,(H,28,31)(H,29,32)