1-[(2-fluorophenyl)methyl]-3-(2-methoxy-5-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[(2-fluorophenyl)methyl]-3-(2-methoxy-5-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(2-fluorophenyl)methyl]-3-(2-methoxy-5-methyl-phenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(2-fluorophenyl)methyl]-3-(2-methoxy-5-methylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(2-fluorophenyl)methyl]-3-(2-methoxy-5-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-fluorobenzyl)-3-(2-methoxy-5-methyl-phenyl)-1-(3-pyridylmethyl)thiourea Formula: C22H22FN3OS MolecularWeight: 395.492983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N(CC2=CN=CC=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C22H22FN3OS/c1-16-9-10-21(27-2)20(12-16)25-22(28)26(14-17-6-5-11-24-13-17)15-18-7-3-4-8-19(18)23/h3-13H,14-15H2,1-2H3,(H,25,28)