1-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methylbutyl)urea

Systemtic Name: 1-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methylbutyl)urea Openeye Name: 1-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-isopentyl-urea CAS Name: 1-[[1-[(2,5-dimethylphenyl)methyl]-2-pyrrolyl]methyl]-3-(3-methylbutyl)urea IUPAC Name: 1-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methylbutyl)urea Traditional Name: 1-[[1-(2,5-dimethylbenzyl)pyrrol-2-yl]methyl]-3-isoamyl-urea Formula: C20H29N3O MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C=CC=C2CNC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C=CC=C2CNC(=O)NCCC(C)C

InChI

InChI=1S/C20H29N3O/c1-15(2)9-10-21-20(24)22-13-19-6-5-11-23(19)14-18-12-16(3)7-8-17(18)4/h5-8,11-12,15H,9-10,13-14H2,1-4H3,(H2,21,22,24)