1-(3,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methoxyphenyl)-2-piperidino-ethyl]thiourea Formula: C23H31N3OS MolecularWeight: 397.57674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC(C2=CC=C(C=C2)OC)N3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC(C2=CC=C(C=C2)OC)N3CCCCC3)C

InChI

InChI=1S/C23H31N3OS/c1-17-7-10-20(15-18(17)2)25-23(28)24-16-22(26-13-5-4-6-14-26)19-8-11-21(27-3)12-9-19/h7-12,15,22H,4-6,13-14,16H2,1-3H3,(H2,24,25,28)