1-(4-butylphenyl)-3-(3-methylpyridin-2-yl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(3-methylpyridin-2-yl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(3-methyl-2-pyridyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(3-methyl-2-pyridinyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(3-methylpyridin-2-yl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(3-methyl-2-pyridyl)thiourea Formula: C17H21N3S MolecularWeight: 299.43374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(C=CC=N2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(C=CC=N2)C

InChI

InChI=1S/C17H21N3S/c1-3-4-7-14-8-10-15(11-9-14)19-17(21)20-16-13(2)6-5-12-18-16/h5-6,8-12H,3-4,7H2,1-2H3,(H2,18,19,20,21)