5-chloranyl-6-ethyl-N-(8-phenylsulfanyloctyl)pyrimidin-4-amine

Systemtic Name: 5-chloranyl-6-ethyl-N-(8-phenylsulfanyloctyl)pyrimidin-4-amine Openeye Name: 5-chloro-6-ethyl-N-(8-phenylsulfanyloctyl)pyrimidin-4-amine CAS Name: 5-chloro-6-ethyl-N-[8-(phenylthio)octyl]-4-pyrimidinamine IUPAC Name: 5-chloro-6-ethyl-N-(8-phenylsulfanyloctyl)pyrimidin-4-amine Traditional Name: (5-chloro-6-ethyl-pyrimidin-4-yl)-[8-(phenylthio)octyl]amine Formula: C20H28ClN3S MolecularWeight: 377.97442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NCCCCCCCCSC2=CC=CC=C2)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NCCCCCCCCSC2=CC=CC=C2)Cl

InChI

InChI=1S/C20H28ClN3S/c1-2-18-19(21)20(24-16-23-18)22-14-10-5-3-4-6-11-15-25-17-12-8-7-9-13-17/h7-9,12-13,16H,2-6,10-11,14-15H2,1H3,(H,22,23,24)