2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-6-methyl-N-(3-nitrophenyl)pyrimidin-4-amine

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-6-methyl-N-(3-nitrophenyl)pyrimidin-4-amine Openeye Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]-6-methyl-N-(3-nitrophenyl)pyrimidin-4-amine CAS Name: 2-[(2,6-dichlorophenyl)methylthio]-6-methyl-N-(3-nitrophenyl)-4-pyrimidinamine IUPAC Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]-6-methyl-N-(3-nitrophenyl)pyrimidin-4-amine Traditional Name: [2-[(2,6-dichlorobenzyl)thio]-6-methyl-pyrimidin-4-yl]-(3-nitrophenyl)amine Formula: C18H14Cl2N4O2S MolecularWeight: 421.30036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=C(C=CC=C2Cl)Cl)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=C(C=CC=C2Cl)Cl)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14Cl2N4O2S/c1-11-8-17(22-12-4-2-5-13(9-12)24(25)26)23-18(21-11)27-10-14-15(19)6-3-7-16(14)20/h2-9H,10H2,1H3,(H,21,22,23)