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

Systemtic Name: 1-butan-2-yl-3-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-3-sec-butyl-urea CAS Name: 1-butan-2-yl-3-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-butan-2-yl-3-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-sec-butyl-urea Formula: C18H25N3O MolecularWeight: 299.4106

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NCC1=CC=CN1CC2=CC=CC(=C2)C

Isomeric SMILES

CCC(C)NC(=O)NCC1=CC=CN1CC2=CC=CC(=C2)C

InChI

InChI=1S/C18H25N3O/c1-4-15(3)20-18(22)19-12-17-9-6-10-21(17)13-16-8-5-7-14(2)11-16/h5-11,15H,4,12-13H2,1-3H3,(H2,19,20,22)