N-(2-methyl-4-nitro-phenyl)-2-phenyl-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-4-nitro-phenyl)-2-phenyl-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(2-methyl-4-nitro-phenyl)-2-phenyl-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-acetamide CAS Name: N-(2-methyl-4-nitrophenyl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]-2-phenylacetamide IUPAC Name: N-(2-methyl-4-nitrophenyl)-2-phenyl-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylacetamide Traditional Name: N-(2-methyl-4-nitro-phenyl)-2-phenyl-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]acetamide Formula: C29H25N3O4S MolecularWeight: 511.5915

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C29H25N3O4S/c1-20-17-24(32(35)36)15-16-26(20)31-29(34)28(22-11-6-3-7-12-22)37-25-14-8-13-23(19-25)30-27(33)18-21-9-4-2-5-10-21/h2-17,19,28H,18H2,1H3,(H,30,33)(H,31,34)