N-[[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine

Systemtic Name: N-[[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine Openeye Name: N-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl]-3-pyrimidin-2-ylsulfanyl-propan-1-amine CAS Name: N-[[5-(3-chloro-2-methylphenyl)-2-furanyl]methyl]-3-(2-pyrimidinylthio)-1-propanamine IUPAC Name: N-[[5-(3-chloro-2-methylphenyl)furan-2-yl]methyl]-3-pyrimidin-2-ylsulfanylpropan-1-amine Traditional Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-[3-(2-pyrimidylthio)propyl]amine Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)CNCCCSC3=NC=CC=N3

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)CNCCCSC3=NC=CC=N3

InChI

InChI=1S/C19H20ClN3OS/c1-14-16(5-2-6-17(14)20)18-8-7-15(24-18)13-21-9-4-12-25-19-22-10-3-11-23-19/h2-3,5-8,10-11,21H,4,9,12-13H2,1H3