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

Systemtic Name: 4-nitro-N-[2-[3-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide Openeye Name: 4-nitro-N-[2-[3-[2-oxo-2-(phenethylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide CAS Name: 4-nitro-N-[2-[3-[[2-oxo-2-(phenethylamino)ethyl]thio]-1-indolyl]ethyl]benzamide IUPAC Name: 4-nitro-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]-4-nitro-benzamide Formula: C27H26N4O4S MolecularWeight: 502.58474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O4S/c32-26(28-15-14-20-6-2-1-3-7-20)19-36-25-18-30(24-9-5-4-8-23(24)25)17-16-29-27(33)21-10-12-22(13-11-21)31(34)35/h1-13,18H,14-17,19H2,(H,28,32)(H,29,33)