3-(3,4-dimethylphenyl)-1-methyl-1-[(2-piperidin-1-ylphenyl)methyl]thiourea

Systemtic Name: 3-(3,4-dimethylphenyl)-1-methyl-1-[(2-piperidin-1-ylphenyl)methyl]thiourea Openeye Name: 3-(3,4-dimethylphenyl)-1-methyl-1-[[2-(1-piperidyl)phenyl]methyl]thiourea CAS Name: 3-(3,4-dimethylphenyl)-1-methyl-1-[[2-(1-piperidinyl)phenyl]methyl]thiourea IUPAC Name: 3-(3,4-dimethylphenyl)-1-methyl-1-[(2-piperidin-1-ylphenyl)methyl]thiourea Traditional Name: 3-(3,4-dimethylphenyl)-1-methyl-1-(2-piperidinobenzyl)thiourea Formula: C22H29N3S MolecularWeight: 367.55076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CC=CC=C2N3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=CC=CC=C2N3CCCCC3)C

InChI

InChI=1S/C22H29N3S/c1-17-11-12-20(15-18(17)2)23-22(26)24(3)16-19-9-5-6-10-21(19)25-13-7-4-8-14-25/h5-6,9-12,15H,4,7-8,13-14,16H2,1-3H3,(H,23,26)