(E)-1-(4-methylphenyl)-3-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-methylphenyl)-3-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]prop-2-en-1-one Openeye Name: (E)-3-[3-nitro-4-(p-tolylsulfanyl)phenyl]-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-1-(4-methylphenyl)-3-[4-[(4-methylphenyl)thio]-3-nitrophenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-methylphenyl)-3-[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]prop-2-en-1-one Traditional Name: (E)-3-[3-nitro-4-(p-tolylthio)phenyl]-1-(p-tolyl)prop-2-en-1-one Formula: C23H19NO3S MolecularWeight: 389.46686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO3S/c1-16-3-9-19(10-4-16)22(25)13-7-18-8-14-23(21(15-18)24(26)27)28-20-11-5-17(2)6-12-20/h3-15H,1-2H3/b13-7+