6-chloranyl-2-(phenylmethylsulfanyl)-5-propan-2-yl-pyrimidin-4-amine

Systemtic Name: 6-chloranyl-2-(phenylmethylsulfanyl)-5-propan-2-yl-pyrimidin-4-amine Openeye Name: 2-benzylsulfanyl-6-chloro-5-isopropyl-pyrimidin-4-amine CAS Name: 6-chloro-2-(phenylmethylthio)-5-propan-2-yl-4-pyrimidinamine IUPAC Name: 2-benzylsulfanyl-6-chloro-5-propan-2-ylpyrimidin-4-amine Traditional Name: [2-(benzylthio)-6-chloro-5-isopropyl-pyrimidin-4-yl]amine Formula: C14H16ClN3S MolecularWeight: 293.81494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=C(N=C1Cl)SCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C1=C(N=C(N=C1Cl)SCC2=CC=CC=C2)N

InChI

InChI=1S/C14H16ClN3S/c1-9(2)11-12(15)17-14(18-13(11)16)19-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H2,16,17,18)