1-(4-tert-butylphenyl)-3-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-2-pyrrolyl)-2-(1-pyrrolidinyl)ethyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-ylethyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[2-(1-methylpyrrol-2-yl)-2-pyrrolidino-ethyl]urea Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)NCC(C2=CC=CN2C)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)NCC(C2=CC=CN2C)N3CCCC3

InChI

InChI=1S/C22H32N4O/c1-22(2,3)17-9-11-18(12-10-17)24-21(27)23-16-20(26-14-5-6-15-26)19-8-7-13-25(19)4/h7-13,20H,5-6,14-16H2,1-4H3,(H2,23,24,27)