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

Systemtic Name: 1-butan-2-yl-3-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-3-sec-butyl-urea CAS Name: 1-butan-2-yl-3-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-butan-2-yl-3-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-[[1-(2-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=C2C

Isomeric SMILES

CCC(C)NC(=O)NCC1=CC=CN1CC2=CC=CC=C2C

InChI

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