4-(aziridin-1-yl)-5-bromanyl-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidine

Systemtic Name: 4-(aziridin-1-yl)-5-bromanyl-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidine Openeye Name: 4-(aziridin-1-yl)-5-bromo-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidine CAS Name: 4-(1-aziridinyl)-5-bromo-2-[(2,4-dichlorophenyl)methylthio]pyrimidine IUPAC Name: 4-(aziridin-1-yl)-5-bromo-2-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidine Traditional Name: 5-bromo-2-[(2,4-dichlorobenzyl)thio]-4-ethylenimino-pyrimidine Formula: C13H10BrCl2N3S MolecularWeight: 391.1136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=NC(=NC=C2Br)SCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN1C2=NC(=NC=C2Br)SCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C13H10BrCl2N3S/c14-10-6-17-13(18-12(10)19-3-4-19)20-7-8-1-2-9(15)5-11(8)16/h1-2,5-6H,3-4,7H2