1-(4-methoxyphenyl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[[2-(1-piperidylmethyl)phenyl]methyl]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[[2-(1-piperidinylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-methoxyphenyl)-3-[2-(piperidinomethyl)benzyl]thiourea Formula: C21H27N3OS MolecularWeight: 369.52358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2CN3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2CN3CCCCC3

InChI

InChI=1S/C21H27N3OS/c1-25-20-11-9-19(10-12-20)23-21(26)22-15-17-7-3-4-8-18(17)16-24-13-5-2-6-14-24/h3-4,7-12H,2,5-6,13-16H2,1H3,(H2,22,23,26)