3-(2,6-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-2-ylethyl)thiourea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-2-ylethyl)thiourea Openeye Name: 3-(2,6-dimethylphenyl)-1-(3-methoxypropyl)-1-[1-(2-pyridyl)ethyl]thiourea CAS Name: 3-(2,6-dimethylphenyl)-1-(3-methoxypropyl)-1-[1-(2-pyridinyl)ethyl]thiourea IUPAC Name: 3-(2,6-dimethylphenyl)-1-(3-methoxypropyl)-1-(1-pyridin-2-ylethyl)thiourea Traditional Name: 3-(2,6-dimethylphenyl)-1-(3-methoxypropyl)-1-[1-(2-pyridyl)ethyl]thiourea Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)N(CCCOC)C(C)C2=CC=CC=N2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N(CCCOC)C(C)C2=CC=CC=N2

InChI

InChI=1S/C20H27N3OS/c1-15-9-7-10-16(2)19(15)22-20(25)23(13-8-14-24-4)17(3)18-11-5-6-12-21-18/h5-7,9-12,17H,8,13-14H2,1-4H3,(H,22,25)