1-[3-[[3-(2-methylpropyl)-1-propan-2-yl-5-propyl-pyrrol-2-yl]methyl]phenyl]urea

Systemtic Name: 1-[3-[[3-(2-methylpropyl)-1-propan-2-yl-5-propyl-pyrrol-2-yl]methyl]phenyl]urea Openeye Name: [3-[(3-isobutyl-1-isopropyl-5-propyl-pyrrol-2-yl)methyl]phenyl]urea CAS Name: [3-[[3-(2-methylpropyl)-1-propan-2-yl-5-propyl-2-pyrrolyl]methyl]phenyl]urea IUPAC Name: [3-[[3-(2-methylpropyl)-1-propan-2-yl-5-propylpyrrol-2-yl]methyl]phenyl]urea Traditional Name: [3-[(3-isobutyl-1-isopropyl-5-propyl-pyrrol-2-yl)methyl]phenyl]urea Formula: C22H33N3O MolecularWeight: 355.51692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(N1C(C)C)CC2=CC(=CC=C2)NC(=O)N)CC(C)C

Isomeric SMILES

CCCC1=CC(=C(N1C(C)C)CC2=CC(=CC=C2)NC(=O)N)CC(C)C

InChI

InChI=1S/C22H33N3O/c1-6-8-20-14-18(11-15(2)3)21(25(20)16(4)5)13-17-9-7-10-19(12-17)24-22(23)26/h7,9-10,12,14-16H,6,8,11,13H2,1-5H3,(H3,23,24,26)