3-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)-1,3-diazinane-1-carbothioamide

Systemtic Name: 3-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)-1,3-diazinane-1-carbothioamide Openeye Name: 3-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)hexahydropyrimidine-1-carbothioamide CAS Name: 3-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)-1,3-diazinane-1-carbothioamide IUPAC Name: 3-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)-1,3-diazinane-1-carbothioamide Traditional Name: 3-(2-fluorobenzyl)-N-(3-methoxyphenyl)hexahydropyrimidine-1-carbothioamide Formula: C19H22FN3OS MolecularWeight: 359.460883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCCN(C2)CC3=CC=CC=C3F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCCN(C2)CC3=CC=CC=C3F

InChI

InChI=1S/C19H22FN3OS/c1-24-17-8-4-7-16(12-17)21-19(25)23-11-5-10-22(14-23)13-15-6-2-3-9-18(15)20/h2-4,6-9,12H,5,10-11,13-14H2,1H3,(H,21,25)