3-(3-chloranyl-4-fluoranyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-(2-cyanoethyl)-1-methylthiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-(2-cyanoethyl)-1-methylthiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Formula: C11H11ClFN3S MolecularWeight: 271.741543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11ClFN3S/c1-16(6-2-5-14)11(17)15-8-3-4-10(13)9(12)7-8/h3-4,7H,2,6H2,1H3,(H,15,17)