propan-2-yl 2,4-dimethyl-5-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methylamino]-oxomethyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-[[3-(2-methylpropanoylamino)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[[3-(isobutyrylamino)benzyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C

InChI

InChI=1S/C22H29N3O4/c1-12(2)20(26)25-17-9-7-8-16(10-17)11-23-21(27)19-14(5)18(15(6)24-19)22(28)29-13(3)4/h7-10,12-13,24H,11H2,1-6H3,(H,23,27)(H,25,26)