6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]-N-prop-2-enyl-pyrimidin-4-amine

Systemtic Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]-N-prop-2-enyl-pyrimidin-4-amine Openeye Name: N-allyl-6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]pyrimidin-4-amine CAS Name: 6-[[(4-chlorophenyl)thio]methyl]-2-[(3,4-dichlorophenyl)methylthio]-N-prop-2-enyl-4-pyrimidinamine IUPAC Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]-N-prop-2-enylpyrimidin-4-amine Traditional Name: allyl-[6-[[(4-chlorophenyl)thio]methyl]-2-[(3,4-dichlorobenzyl)thio]pyrimidin-4-yl]amine Formula: C21H18Cl3N3S2 MolecularWeight: 482.87672

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=NC(=C1)CSC2=CC=C(C=C2)Cl)SCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C=CCNC1=NC(=NC(=C1)CSC2=CC=C(C=C2)Cl)SCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H18Cl3N3S2/c1-2-9-25-20-11-16(13-28-17-6-4-15(22)5-7-17)26-21(27-20)29-12-14-3-8-18(23)19(24)10-14/h2-8,10-11H,1,9,12-13H2,(H,25,26,27)