1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-(2-cyanoethyl)-3-(4-fluorophenyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-fluorophenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-(2-cyanoethyl)-3-(4-fluorophenyl)thiourea Traditional Name: 1-benzyl-1-(2-cyanoethyl)-3-(4-fluorophenyl)thiourea Formula: C17H16FN3S MolecularWeight: 313.392443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C17H16FN3S/c18-15-7-9-16(10-8-15)20-17(22)21(12-4-11-19)13-14-5-2-1-3-6-14/h1-3,5-10H,4,12-13H2,(H,20,22)