3,4,5-trimethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H21N3O5S2/c1-26-14-7-5-12(6-8-14)15-11-31-21(22-15)24-20(30)23-19(25)13-9-16(27-2)18(29-4)17(10-13)28-3/h5-11H,1-4H3,(H2,22,23,24,25,30)