2-[(4-chlorophenyl)methylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine hydrochloride

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine hydrochloride Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine hydrochloride CAS Name: 2-[(4-chlorophenyl)methylthio]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine hydrochloride IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine hydrochloride Traditional Name: 2-[(4-chlorobenzyl)thio]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine hydrochloride Formula: C13H18Cl2N2S MolecularWeight: 305.26642

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC(=NC1)SCC2=CC=C(C=C2)Cl)C.Cl

Isomeric SMILES

CC1(CNC(=NC1)SCC2=CC=C(C=C2)Cl)C.Cl

InChI

InChI=1S/C13H17ClN2S.ClH/c1-13(2)8-15-12(16-9-13)17-7-10-3-5-11(14)6-4-10;/h3-6H,7-9H2,1-2H3,(H,15,16);1H