2-[(9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[(9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[(9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[(9-methoxy-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[(9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[(9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl)thio]-1-piperidino-ethanone Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=C(C2)C(=NC(=N3)C4=CC=CC=C4)SCC(=O)N5CCCCC5

Isomeric SMILES

COC1=CC=CC2=C1OC3=C(C2)C(=NC(=N3)C4=CC=CC=C4)SCC(=O)N5CCCCC5

InChI

InChI=1S/C25H25N3O3S/c1-30-20-12-8-11-18-15-19-24(31-22(18)20)26-23(17-9-4-2-5-10-17)27-25(19)32-16-21(29)28-13-6-3-7-14-28/h2,4-5,8-12H,3,6-7,13-16H2,1H3