2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-methyl-N-prop-2-ynyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-methyl-N-prop-2-ynyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]-4-piperidyl]-N-methyl-N-prop-2-ynyl-thiazole-4-carboxamide CAS Name: 2-[1-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]-4-piperidinyl]-N-methyl-N-prop-2-ynyl-4-thiazolecarboxamide IUPAC Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-methyl-N-prop-2-ynyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[(4-dimethylaminophenyl)thiocarbamoyl]-4-piperidyl]-N-methyl-N-propargyl-thiazole-4-carboxamide Formula: C22H27N5OS2 MolecularWeight: 441.61268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)N(C)CC#C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C3=NC(=CS3)C(=O)N(C)CC#C

InChI

InChI=1S/C22H27N5OS2/c1-5-12-26(4)21(28)19-15-30-20(24-19)16-10-13-27(14-11-16)22(29)23-17-6-8-18(9-7-17)25(2)3/h1,6-9,15-16H,10-14H2,2-4H3,(H,23,29)