6-(4-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-2-phenyl-pyrimidin-4-amine

Systemtic Name: 6-(4-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-2-phenyl-pyrimidin-4-amine Openeye Name: 6-(4-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-2-phenyl-pyrimidin-4-amine CAS Name: 6-[(4-chlorophenyl)thio]-N-(3-methoxypropyl)-2-phenyl-4-pyrimidinamine IUPAC Name: 6-(4-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-2-phenylpyrimidin-4-amine Traditional Name: [6-[(4-chlorophenyl)thio]-2-phenyl-pyrimidin-4-yl]-(3-methoxypropyl)amine Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=CC(=NC(=N1)C2=CC=CC=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

COCCCNC1=CC(=NC(=N1)C2=CC=CC=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-25-13-5-12-22-18-14-19(26-17-10-8-16(21)9-11-17)24-20(23-18)15-6-3-2-4-7-15/h2-4,6-11,14H,5,12-13H2,1H3,(H,22,23,24)