4-methyl-3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[4-[(phenylthio)methyl]phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[4-(phenylsulfanylmethyl)phenyl]benzamide Traditional Name: 4-methyl-3-nitro-N-[4-[(phenylthio)methyl]phenyl]benzamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O3S/c1-15-7-10-17(13-20(15)23(25)26)21(24)22-18-11-8-16(9-12-18)14-27-19-5-3-2-4-6-19/h2-13H,14H2,1H3,(H,22,24)