1-(3-methoxypropyl)-1-(1-pyridin-2-ylethyl)-3-(2,4,6-trimethylphenyl)thiourea

Systemtic Name: 1-(3-methoxypropyl)-1-(1-pyridin-2-ylethyl)-3-(2,4,6-trimethylphenyl)thiourea Openeye Name: 1-(3-methoxypropyl)-1-[1-(2-pyridyl)ethyl]-3-(2,4,6-trimethylphenyl)thiourea CAS Name: 1-(3-methoxypropyl)-1-[1-(2-pyridinyl)ethyl]-3-(2,4,6-trimethylphenyl)thiourea IUPAC Name: 1-(3-methoxypropyl)-1-(1-pyridin-2-ylethyl)-3-(2,4,6-trimethylphenyl)thiourea Traditional Name: 3-mesityl-1-(3-methoxypropyl)-1-[1-(2-pyridyl)ethyl]thiourea Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3OS/c1-15-13-16(2)20(17(3)14-15)23-21(26)24(11-8-12-25-5)18(4)19-9-6-7-10-22-19/h6-7,9-10,13-14,18H,8,11-12H2,1-5H3,(H,23,26)