2-azanyl-2-[6-(4-methoxyoxan-4-yl)pyrimidin-4-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-azanyl-2-[6-(4-methoxyoxan-4-yl)pyrimidin-4-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 2-amino-2-[6-(4-methoxytetrahydropyran-4-yl)pyrimidin-4-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-amino-2-[[6-(4-methoxy-4-oxanyl)-4-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-amino-2-[6-(4-methoxyoxan-4-yl)pyrimidin-4-yl]sulfanyl-1-phenylethanone Traditional Name: 2-amino-2-[[6-(4-methoxytetrahydropyran-4-yl)pyrimidin-4-yl]thio]-1-phenyl-ethanone Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCOCC1)C2=CC(=NC=N2)SC(C(=O)C3=CC=CC=C3)N

Isomeric SMILES

COC1(CCOCC1)C2=CC(=NC=N2)SC(C(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C18H21N3O3S/c1-23-18(7-9-24-10-8-18)14-11-15(21-12-20-14)25-17(19)16(22)13-5-3-2-4-6-13/h2-6,11-12,17H,7-10,19H2,1H3