3-(3,5-dimethylphenyl)-1-(3-piperidin-1-ylpropyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(3,5-dimethylphenyl)-1-(3-piperidin-1-ylpropyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(3,5-dimethylphenyl)-1-[3-(1-piperidyl)propyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-(3,5-dimethylphenyl)-1-[3-(1-piperidinyl)propyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(3,5-dimethylphenyl)-1-(3-piperidin-1-ylpropyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(3,5-dimethylphenyl)-1-(3-piperidinopropyl)-1-(2-thenyl)thiourea Formula: C22H31N3S2 MolecularWeight: 401.63164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N(CCCN2CCCCC2)CC3=CC=CS3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N(CCCN2CCCCC2)CC3=CC=CS3)C

InChI

InChI=1S/C22H31N3S2/c1-18-14-19(2)16-20(15-18)23-22(26)25(17-21-8-6-13-27-21)12-7-11-24-9-4-3-5-10-24/h6,8,13-16H,3-5,7,9-12,17H2,1-2H3,(H,23,26)