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

Systemtic Name: N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: N-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[[4-(4-methoxyphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21N3O2S2/c1-13(2)14-4-6-16(7-5-14)19(25)23-20(27)24-21-22-18(12-28-21)15-8-10-17(26-3)11-9-15/h4-13H,1-3H3,(H2,22,23,24,25,27)