[3-(butylcarbamoylamino)-5-methyl-phenyl] 2-[(4-cyanophenyl)amino]ethanoate

Systemtic Name: [3-(butylcarbamoylamino)-5-methyl-phenyl] 2-[(4-cyanophenyl)amino]ethanoate Openeye Name: [3-(butylcarbamoylamino)-5-methyl-phenyl] 2-(4-cyanoanilino)acetate CAS Name: 2-(4-cyanoanilino)acetic acid [3-[[butylamino(oxo)methyl]amino]-5-methylphenyl] ester IUPAC Name: [3-(butylcarbamoylamino)-5-methylphenyl] 2-(4-cyanoanilino)acetate Traditional Name: 2-(4-cyanoanilino)acetic acid [3-(butylcarbamoylamino)-5-methyl-phenyl] ester Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC(=CC(=C1)C)OC(=O)CNC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCNC(=O)NC1=CC(=CC(=C1)C)OC(=O)CNC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H24N4O3/c1-3-4-9-23-21(27)25-18-10-15(2)11-19(12-18)28-20(26)14-24-17-7-5-16(13-22)6-8-17/h5-8,10-12,24H,3-4,9,14H2,1-2H3,(H2,23,25,27)