3-(3,5-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-4-ylethyl)thiourea

Systemtic Name: 3-(3,5-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-4-ylethyl)thiourea Openeye Name: 3-(3,5-dimethylphenyl)-1-(3-methoxypropyl)-1-[1-(4-pyridyl)ethyl]thiourea CAS Name: 3-(3,5-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-4-ylethyl)thiourea IUPAC Name: 3-(3,5-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-4-ylethyl)thiourea Traditional Name: 3-(3,5-dimethylphenyl)-1-(3-methoxypropyl)-1-[1-(4-pyridyl)ethyl]thiourea Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N(CCCOC)C(C)C2=CC=NC=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N(CCCOC)C(C)C2=CC=NC=C2)C

InChI

InChI=1S/C20H27N3OS/c1-15-12-16(2)14-19(13-15)22-20(25)23(10-5-11-24-4)17(3)18-6-8-21-9-7-18/h6-9,12-14,17H,5,10-11H2,1-4H3,(H,22,25)