3,4,5-triethoxy-N-[[4-(4-methyl-1,3-thiazol-2-yl)-2-phenyl-pyrazol-3-yl]carbamothioyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[[4-(4-methyl-1,3-thiazol-2-yl)-2-phenyl-pyrazol-3-yl]carbamothioyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[[4-(4-methylthiazol-2-yl)-2-phenyl-pyrazol-3-yl]carbamothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[[[4-(4-methyl-2-thiazolyl)-2-phenyl-3-pyrazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[[4-(4-methyl-1,3-thiazol-2-yl)-2-phenylpyrazol-3-yl]carbamothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[[4-(4-methylthiazol-2-yl)-2-phenyl-pyrazol-3-yl]thiocarbamoyl]benzamide Formula: C27H29N5O4S2 MolecularWeight: 551.68026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C=NN2C3=CC=CC=C3)C4=NC(=CS4)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C=NN2C3=CC=CC=C3)C4=NC(=CS4)C

InChI

InChI=1S/C27H29N5O4S2/c1-5-34-21-13-18(14-22(35-6-2)23(21)36-7-3)25(33)31-27(37)30-24-20(26-29-17(4)16-38-26)15-28-32(24)19-11-9-8-10-12-19/h8-16H,5-7H2,1-4H3,(H2,30,31,33,37)