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

Systemtic Name: 1-(2-cyanoethyl)-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C11H12FN3S MolecularWeight: 237.296483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCC#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCC#N)F

InChI

InChI=1S/C11H12FN3S/c1-8-3-4-9(7-10(8)12)15-11(16)14-6-2-5-13/h3-4,7H,2,6H2,1H3,(H2,14,15,16)