3-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide

Systemtic Name: 3-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide Openeye Name: 3-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)hexahydropyrimidine-1-carbothioamide CAS Name: 3-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide IUPAC Name: 3-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1,3-diazinane-1-carbothioamide Traditional Name: 3-(3-chlorobenzyl)-N-(4-methoxyphenyl)hexahydropyrimidine-1-carbothioamide Formula: C19H22ClN3OS MolecularWeight: 375.91548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N2CCCN(C2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N2CCCN(C2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H22ClN3OS/c1-24-18-8-6-17(7-9-18)21-19(25)23-11-3-10-22(14-23)13-15-4-2-5-16(20)12-15/h2,4-9,12H,3,10-11,13-14H2,1H3,(H,21,25)