methyl 4-[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-furylmethyl(2-thienylmethyl)amino]acetyl]amino]benzoate CAS Name: 4-[[2-[2-furanylmethyl(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-furfuryl(2-thenyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=CO2)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=CO2)CC3=CC=CS3

InChI

InChI=1S/C20H20N2O4S/c1-25-20(24)15-6-8-16(9-7-15)21-19(23)14-22(12-17-4-2-10-26-17)13-18-5-3-11-27-18/h2-11H,12-14H2,1H3,(H,21,23)