methyl 4-[[2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl]amino]benzoate

Systemtic Name: methyl 4-[[2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl]amino]benzoate Openeye Name: methyl 4-[[2-oxo-2-[[phenyl(2-thienyl)methyl]amino]ethyl]amino]benzoate CAS Name: 4-[[2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl]amino]benzoate Traditional Name: 4-[[2-keto-2-[[phenyl(2-thienyl)methyl]amino]ethyl]amino]benzoic acid methyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C21H20N2O3S/c1-26-21(25)16-9-11-17(12-10-16)22-14-19(24)23-20(18-8-5-13-27-18)15-6-3-2-4-7-15/h2-13,20,22H,14H2,1H3,(H,23,24)