azanyl 2-[[4-(2-cyanophenyl)phenyl]methyl]-3-(propylsulfanylcarbamoylamino)benzoate

Systemtic Name: azanyl 2-[[4-(2-cyanophenyl)phenyl]methyl]-3-(propylsulfanylcarbamoylamino)benzoate Openeye Name: amino 2-[[4-(2-cyanophenyl)phenyl]methyl]-3-(propylsulfanylcarbamoylamino)benzoate CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methyl]-3-[[oxo-[(propylthio)amino]methyl]amino]benzoic acid amino ester IUPAC Name: amino 2-[[4-(2-cyanophenyl)phenyl]methyl]-3-(propylsulfanylcarbamoylamino)benzoate Traditional Name: 2-[4-(2-cyanophenyl)benzyl]-3-[(propylthio)carbamoylamino]benzoic acid amino ester Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CCCSNC(=O)NC1=CC=CC(=C1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C(=O)ON

Isomeric SMILES

CCCSNC(=O)NC1=CC=CC(=C1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C(=O)ON

InChI

InChI=1S/C25H24N4O3S/c1-2-14-33-29-25(31)28-23-9-5-8-21(24(30)32-27)22(23)15-17-10-12-18(13-11-17)20-7-4-3-6-19(20)16-26/h3-13H,2,14-15,27H2,1H3,(H2,28,29,31)