3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea

Systemtic Name: 3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-tert-butyl-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-1-prop-2-enylurea IUPAC Name: 3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea Traditional Name: 1-allyl-3-tert-butyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C21H29N3O MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)NC(C)(C)C

InChI

InChI=1S/C21H29N3O/c1-6-13-24(20(25)22-21(3,4)5)16-19-12-9-14-23(19)15-18-11-8-7-10-17(18)2/h6-12,14H,1,13,15-16H2,2-5H3,(H,22,25)