1-(3-bromophenyl)-3-[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]urea

Systemtic Name: 1-(3-bromophenyl)-3-[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]urea Openeye Name: 1-(3-bromophenyl)-3-[4-[butyl(2-furylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]urea CAS Name: 1-(3-bromophenyl)-3-[4-[butyl(2-furanylmethyl)amino]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]urea IUPAC Name: 1-(3-bromophenyl)-3-[4-[butyl(furan-2-ylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]urea Traditional Name: 1-(3-bromophenyl)-3-[4-[butyl(2-furfuryl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]urea Formula: C27H31BrN4O3 MolecularWeight: 539.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)Br)C(=O)N4CCCC4

Isomeric SMILES

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)Br)C(=O)N4CCCC4

InChI

InChI=1S/C27H31BrN4O3/c1-2-3-13-32(19-23-10-7-16-35-23)25-12-11-22(18-24(25)26(33)31-14-4-5-15-31)30-27(34)29-21-9-6-8-20(28)17-21/h6-12,16-18H,2-5,13-15,19H2,1H3,(H2,29,30,34)