1-(3-chloranyl-4-fluoranyl-phenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1,1-diethylprop-2-ynyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(1,1-diethylprop-2-ynyl)thiourea Formula: C14H16ClFN2S MolecularWeight: 298.806643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=S)NC1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CCC(CC)(C#C)NC(=S)NC1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C14H16ClFN2S/c1-4-14(5-2,6-3)18-13(19)17-10-7-8-12(16)11(15)9-10/h1,7-9H,5-6H2,2-3H3,(H2,17,18,19)