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

Systemtic Name: 1-(4-butylphenyl)-3-(2-chloranylpyridin-3-yl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(2-chloro-3-pyridyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(2-chloro-3-pyridinyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(2-chloropyridin-3-yl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(2-chloro-3-pyridyl)thiourea Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(N=CC=C2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C16H18ClN3S/c1-2-3-5-12-7-9-13(10-8-12)19-16(21)20-14-6-4-11-18-15(14)17/h4,6-11H,2-3,5H2,1H3,(H2,19,20,21)