3-[(4-fluorophenyl)methyl]-N-(3-methylphenyl)-1,3-diazinane-1-carbothioamide

Systemtic Name: 3-[(4-fluorophenyl)methyl]-N-(3-methylphenyl)-1,3-diazinane-1-carbothioamide Openeye Name: 3-[(4-fluorophenyl)methyl]-N-(m-tolyl)hexahydropyrimidine-1-carbothioamide CAS Name: 3-[(4-fluorophenyl)methyl]-N-(3-methylphenyl)-1,3-diazinane-1-carbothioamide IUPAC Name: 3-[(4-fluorophenyl)methyl]-N-(3-methylphenyl)-1,3-diazinane-1-carbothioamide Traditional Name: 3-(4-fluorobenzyl)-N-(m-tolyl)hexahydropyrimidine-1-carbothioamide Formula: C19H22FN3S MolecularWeight: 343.461483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CCCN(C2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CCCN(C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H22FN3S/c1-15-4-2-5-18(12-15)21-19(24)23-11-3-10-22(14-23)13-16-6-8-17(20)9-7-16/h2,4-9,12H,3,10-11,13-14H2,1H3,(H,21,24)