N-(2-methyl-5-nitro-phenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(oxo)methyl]amino]phenyl]thio]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanylacetamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-2-[[4-(phenylcarbamoylamino)phenyl]thio]acetamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H20N4O4S/c1-15-7-10-18(26(29)30)13-20(15)25-21(27)14-31-19-11-8-17(9-12-19)24-22(28)23-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,25,27)(H2,23,24,28)