2-methyl-3-nitro-N-(phenylmethyl)-N-[(4-phenylsulfanylphenyl)methyl]aniline

Systemtic Name: 2-methyl-3-nitro-N-(phenylmethyl)-N-[(4-phenylsulfanylphenyl)methyl]aniline Openeye Name: N-benzyl-2-methyl-3-nitro-N-[(4-phenylsulfanylphenyl)methyl]aniline CAS Name: 2-methyl-3-nitro-N-(phenylmethyl)-N-[[4-(phenylthio)phenyl]methyl]aniline IUPAC Name: N-benzyl-2-methyl-3-nitro-N-[(4-phenylsulfanylphenyl)methyl]aniline Traditional Name: benzyl-(2-methyl-3-nitro-phenyl)-[4-(phenylthio)benzyl]amine Formula: C27H24N2O2S MolecularWeight: 440.55666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])N(CC2=CC=CC=C2)CC3=CC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])N(CC2=CC=CC=C2)CC3=CC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O2S/c1-21-26(13-8-14-27(21)29(30)31)28(19-22-9-4-2-5-10-22)20-23-15-17-25(18-16-23)32-24-11-6-3-7-12-24/h2-18H,19-20H2,1H3