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

Systemtic Name: 3-ethyl-1-(3-methylbutan-2-yl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-(1,2-dimethylpropyl)-3-ethyl-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 3-ethyl-1-(3-methylbutan-2-yl)-1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 3-ethyl-1-(3-methylbutan-2-yl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-(1,2-dimethylpropyl)-3-ethyl-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CC1=CC=CN1CC2=CC=CC(=C2)C)C(C)C(C)C

Isomeric SMILES

CCNC(=O)N(CC1=CC=CN1CC2=CC=CC(=C2)C)C(C)C(C)C

InChI

InChI=1S/C21H31N3O/c1-6-22-21(25)24(18(5)16(2)3)15-20-11-8-12-23(20)14-19-10-7-9-17(4)13-19/h7-13,16,18H,6,14-15H2,1-5H3,(H,22,25)