N-(3-methylsulfanylphenyl)-4-[1-[(4-propan-2-ylphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(3-methylsulfanylphenyl)-4-[1-[(4-propan-2-ylphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: 4-[1-[(4-isopropylphenyl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide CAS Name: N-[3-(methylthio)phenyl]-4-[1-[(4-propan-2-ylphenyl)methyl]-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(3-methylsulfanylphenyl)-4-[1-[(4-propan-2-ylphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: 4-[1-(4-isopropylbenzyl)imidazol-2-yl]-N-[3-(methylthio)phenyl]piperidine-1-carbothioamide Formula: C26H32N4S2 MolecularWeight: 464.68908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC(=CC=C4)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C26H32N4S2/c1-19(2)21-9-7-20(8-10-21)18-30-16-13-27-25(30)22-11-14-29(15-12-22)26(31)28-23-5-4-6-24(17-23)32-3/h4-10,13,16-17,19,22H,11-12,14-15,18H2,1-3H3,(H,28,31)