4-azanyl-5-(2-methylphenyl)carbonyl-2-(4-phenoxyphenyl)-1H-pyrrole-3-carboxamide

Systemtic Name: 4-azanyl-5-(2-methylphenyl)carbonyl-2-(4-phenoxyphenyl)-1H-pyrrole-3-carboxamide Openeye Name: 4-amino-5-(2-methylbenzoyl)-2-(4-phenoxyphenyl)-1H-pyrrole-3-carboxamide CAS Name: 4-amino-5-[(2-methylphenyl)-oxomethyl]-2-(4-phenoxyphenyl)-1H-pyrrole-3-carboxamide IUPAC Name: 4-amino-5-(2-methylbenzoyl)-2-(4-phenoxyphenyl)-1H-pyrrole-3-carboxamide Traditional Name: 4-amino-5-o-toluoyl-2-(4-phenoxyphenyl)-1H-pyrrole-3-carboxamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=C(C(=C(N2)C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)N)N

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=C(C(=C(N2)C3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)N)N

InChI

InChI=1S/C25H21N3O3/c1-15-7-5-6-10-19(15)24(29)23-21(26)20(25(27)30)22(28-23)16-11-13-18(14-12-16)31-17-8-3-2-4-9-17/h2-14,28H,26H2,1H3,(H2,27,30)