3-(3,4-dimethylphenyl)-1-(1-ethanoylpiperidin-4-yl)-1-(3-propan-2-yloxypropyl)thiourea

Systemtic Name: 3-(3,4-dimethylphenyl)-1-(1-ethanoylpiperidin-4-yl)-1-(3-propan-2-yloxypropyl)thiourea Openeye Name: 1-(1-acetyl-4-piperidyl)-3-(3,4-dimethylphenyl)-1-(3-isopropoxypropyl)thiourea CAS Name: 1-(1-acetyl-4-piperidinyl)-3-(3,4-dimethylphenyl)-1-(3-propan-2-yloxypropyl)thiourea IUPAC Name: 1-(1-acetylpiperidin-4-yl)-3-(3,4-dimethylphenyl)-1-(3-propan-2-yloxypropyl)thiourea Traditional Name: 1-(1-acetyl-4-piperidyl)-3-(3,4-dimethylphenyl)-1-(3-isopropoxypropyl)thiourea Formula: C22H35N3O2S MolecularWeight: 405.5972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CCCOC(C)C)C2CCN(CC2)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CCCOC(C)C)C2CCN(CC2)C(=O)C)C

InChI

InChI=1S/C22H35N3O2S/c1-16(2)27-14-6-11-25(21-9-12-24(13-10-21)19(5)26)22(28)23-20-8-7-17(3)18(4)15-20/h7-8,15-16,21H,6,9-14H2,1-5H3,(H,23,28)