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

Systemtic Name: 1-(3-methylbutyl)-3-(2-methylphenyl)-1-(1-pyridin-4-ylethyl)thiourea Openeye Name: 1-isopentyl-3-(o-tolyl)-1-[1-(4-pyridyl)ethyl]thiourea CAS Name: 1-(3-methylbutyl)-3-(2-methylphenyl)-1-(1-pyridin-4-ylethyl)thiourea IUPAC Name: 1-(3-methylbutyl)-3-(2-methylphenyl)-1-(1-pyridin-4-ylethyl)thiourea Traditional Name: 1-isoamyl-3-(o-tolyl)-1-[1-(4-pyridyl)ethyl]thiourea Formula: C20H27N3S MolecularWeight: 341.51348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N(CCC(C)C)C(C)C2=CC=NC=C2

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N(CCC(C)C)C(C)C2=CC=NC=C2

InChI

InChI=1S/C20H27N3S/c1-15(2)11-14-23(17(4)18-9-12-21-13-10-18)20(24)22-19-8-6-5-7-16(19)3/h5-10,12-13,15,17H,11,14H2,1-4H3,(H,22,24)