2-(3-azanylpropylsulfanyl)-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(3-azanylpropylsulfanyl)-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(3-aminopropylsulfanyl)-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(3-aminopropylthio)-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(3-aminopropylsulfanyl)-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(3-aminopropylthio)-5-(4-chlorobenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C15H18ClN3OS MolecularWeight: 323.84092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCCCN)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCCCN)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN3OS/c1-10-13(9-11-3-5-12(16)6-4-11)14(20)19-15(18-10)21-8-2-7-17/h3-6H,2,7-9,17H2,1H3,(H,18,19,20)