1-(3-methylbutyl)-3-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea

Systemtic Name: 1-(3-methylbutyl)-3-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-isopentyl-3-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-(3-methylbutyl)-3-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-(3-methylbutyl)-3-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-isoamyl-3-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C19H27N3O MolecularWeight: 313.43718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O/c1-15(2)9-10-20-19(23)21-13-18-8-5-11-22(18)14-17-7-4-6-16(3)12-17/h4-8,11-12,15H,9-10,13-14H2,1-3H3,(H2,20,21,23)