4-azanyl-2-[3-(4-chloranylphenoxy)propylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[3-(4-chloranylphenoxy)propylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[3-(4-chlorophenoxy)propylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[3-(4-chlorophenoxy)propylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[3-(4-chlorophenoxy)propylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[3-(4-chlorophenoxy)propylthio]pyrimidine-5-carbonitrile Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCSC2=NC=C(C(=N2)N)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCSC2=NC=C(C(=N2)N)C#N)Cl

InChI

InChI=1S/C14H13ClN4OS/c15-11-2-4-12(5-3-11)20-6-1-7-21-14-18-9-10(8-16)13(17)19-14/h2-5,9H,1,6-7H2,(H2,17,18,19)