methyl 2-[[(2-methoxyphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]carbamothioyl]amino]benzoate

Systemtic Name: methyl 2-[[(2-methoxyphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]carbamothioyl]amino]benzoate Openeye Name: methyl 2-[[(2-methoxyphenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]carbamothioyl]amino]benzoate CAS Name: 2-[[[(2-methoxyphenyl)methyl-[[(2R)-2-oxolanyl]methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(2-methoxyphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]carbamothioyl]amino]benzoate Traditional Name: 2-[[o-anisyl-[[(2R)-tetrahydrofuran-2-yl]methyl]thiocarbamoyl]amino]benzoic acid methyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC2CCCO2)C(=S)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1CN(C[C@H]2CCCO2)C(=S)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H26N2O4S/c1-26-20-12-6-3-8-16(20)14-24(15-17-9-7-13-28-17)22(29)23-19-11-5-4-10-18(19)21(25)27-2/h3-6,8,10-12,17H,7,9,13-15H2,1-2H3,(H,23,29)/t17-/m1/s1