N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide Openeye Name: N-[4,5-bis(p-tolyl)thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-[4,5-bis(4-methylphenyl)-2-thiazolyl]-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: N-[4,5-bis(p-tolyl)thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC(=CN3C)[N+](=O)[O-])C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC(=CN3C)[N+](=O)[O-])C4=CC=C(C=C4)C

InChI

InChI=1S/C23H20N4O3S/c1-14-4-8-16(9-5-14)20-21(17-10-6-15(2)7-11-17)31-23(24-20)25-22(28)19-12-18(27(29)30)13-26(19)3/h4-13H,1-3H3,(H,24,25,28)