2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-(2-methyl-1,3-benzothiazol-5-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-(2-methyl-1,3-benzothiazol-5-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]-4-piperidyl]-N-(2-methyl-1,3-benzothiazol-5-yl)thiazole-4-carboxamide CAS Name: 2-[1-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]-4-piperidinyl]-N-(2-methyl-1,3-benzothiazol-5-yl)-4-thiazolecarboxamide IUPAC Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-(2-methyl-1,3-benzothiazol-5-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[(4-dimethylaminophenyl)thiocarbamoyl]-4-piperidyl]-N-(2-methyl-1,3-benzothiazol-5-yl)thiazole-4-carboxamide Formula: C26H28N6OS3 MolecularWeight: 536.73512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=S)NC5=CC=C(C=C5)N(C)C

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=S)NC5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C26H28N6OS3/c1-16-27-21-14-19(6-9-23(21)36-16)28-24(33)22-15-35-25(30-22)17-10-12-32(13-11-17)26(34)29-18-4-7-20(8-5-18)31(2)3/h4-9,14-15,17H,10-13H2,1-3H3,(H,28,33)(H,29,34)