1-(2-cyanoethyl)-3-(2,5-dimethylphenyl)-1-(2-fluorophenyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(2,5-dimethylphenyl)-1-(2-fluorophenyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(2,5-dimethylphenyl)-1-(2-fluorophenyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(2,5-dimethylphenyl)-1-(2-fluorophenyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(2,5-dimethylphenyl)-1-(2-fluorophenyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(2,5-dimethylphenyl)-1-(2-fluorophenyl)thiourea Formula: C18H18FN3S MolecularWeight: 327.419023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CCC#N)C2=CC=CC=C2F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CCC#N)C2=CC=CC=C2F

InChI

InChI=1S/C18H18FN3S/c1-13-8-9-14(2)16(12-13)21-18(23)22(11-5-10-20)17-7-4-3-6-15(17)19/h3-4,6-9,12H,5,11H2,1-2H3,(H,21,23)