2-[4-[1,3-bis(4-methylphenyl)imidazolidin-2-yl]-2-nitro-phenyl]sulfanyl-1-methyl-imidazole

Systemtic Name: 2-[4-[1,3-bis(4-methylphenyl)imidazolidin-2-yl]-2-nitro-phenyl]sulfanyl-1-methyl-imidazole Openeye Name: 2-[4-[1,3-bis(p-tolyl)imidazolidin-2-yl]-2-nitro-phenyl]sulfanyl-1-methyl-imidazole CAS Name: 2-[[4-[1,3-bis(4-methylphenyl)-2-imidazolidinyl]-2-nitrophenyl]thio]-1-methylimidazole IUPAC Name: 2-[4-[1,3-bis(4-methylphenyl)imidazolidin-2-yl]-2-nitrophenyl]sulfanyl-1-methylimidazole Traditional Name: 2-[[4-[1,3-bis(p-tolyl)imidazolidin-2-yl]-2-nitro-phenyl]thio]-1-methyl-imidazole Formula: C27H27N5O2S MolecularWeight: 485.60058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(C2C3=CC(=C(C=C3)SC4=NC=CN4C)[N+](=O)[O-])C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(C2C3=CC(=C(C=C3)SC4=NC=CN4C)[N+](=O)[O-])C5=CC=C(C=C5)C

InChI

InChI=1S/C27H27N5O2S/c1-19-4-9-22(10-5-19)30-16-17-31(23-11-6-20(2)7-12-23)26(30)21-8-13-25(24(18-21)32(33)34)35-27-28-14-15-29(27)3/h4-15,18,26H,16-17H2,1-3H3