ethyl 4-[[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-[butyl(2-furylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]carbamoylamino]benzoate CAS Name: 4-[[[4-[butyl(2-furanylmethyl)amino]-3-[oxo(1-pyrrolidinyl)methyl]anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[butyl(furan-2-ylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-[butyl(2-furfuryl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C30H36N4O5 MolecularWeight: 532.63064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H36N4O5/c1-3-5-16-34(21-25-9-8-19-39-25)27-15-14-24(20-26(27)28(35)33-17-6-7-18-33)32-30(37)31-23-12-10-22(11-13-23)29(36)38-4-2/h8-15,19-20H,3-7,16-18,21H2,1-2H3,(H2,31,32,37)