2-(cyclopropylmethylsulfanyl)-5-[(3,4-dichlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(cyclopropylmethylsulfanyl)-5-[(3,4-dichlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(cyclopropylmethylsulfanyl)-5-[(3,4-dichlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(cyclopropylmethylthio)-5-[(3,4-dichlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(cyclopropylmethylsulfanyl)-5-[(3,4-dichlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(cyclopropylmethylthio)-5-(3,4-dichlorobenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C16H16Cl2N2OS MolecularWeight: 355.28204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2CC2)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2CC2)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H16Cl2N2OS/c1-9-12(6-11-4-5-13(17)14(18)7-11)15(21)20-16(19-9)22-8-10-2-3-10/h4-5,7,10H,2-3,6,8H2,1H3,(H,19,20,21)