3-(2-ethylphenyl)-1-(3-methylbutyl)-1-(1-pyridin-4-ylethyl)thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-(3-methylbutyl)-1-(1-pyridin-4-ylethyl)thiourea Openeye Name: 3-(2-ethylphenyl)-1-isopentyl-1-[1-(4-pyridyl)ethyl]thiourea CAS Name: 3-(2-ethylphenyl)-1-(3-methylbutyl)-1-(1-pyridin-4-ylethyl)thiourea IUPAC Name: 3-(2-ethylphenyl)-1-(3-methylbutyl)-1-(1-pyridin-4-ylethyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-isoamyl-1-[1-(4-pyridyl)ethyl]thiourea Formula: C21H29N3S MolecularWeight: 355.54006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CCC(C)C)C(C)C2=CC=NC=C2

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CCC(C)C)C(C)C2=CC=NC=C2

InChI

InChI=1S/C21H29N3S/c1-5-18-8-6-7-9-20(18)23-21(25)24(15-12-16(2)3)17(4)19-10-13-22-14-11-19/h6-11,13-14,16-17H,5,12,15H2,1-4H3,(H,23,25)