1-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-3-(2-methylpropyl)urea

Systemtic Name: 1-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-3-(2-methylpropyl)urea Openeye Name: 1-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxo-ethyl]-3-isobutyl-urea CAS Name: 1-[2-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-oxoethyl]-3-(2-methylpropyl)urea IUPAC Name: 1-[2-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-oxoethyl]-3-(2-methylpropyl)urea Traditional Name: 1-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-keto-ethyl]-3-isobutyl-urea Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CNC(=O)NCC(C)C

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CNC(=O)NCC(C)C

InChI

InChI=1S/C21H29N3O2/c1-15(2)13-22-21(26)23-14-20(25)19-12-16(3)24(17(19)4)11-10-18-8-6-5-7-9-18/h5-9,12,15H,10-11,13-14H2,1-4H3,(H2,22,23,26)