6-[2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoyl]-4-propyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoyl]-4-propyl-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4-propyl-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]ethyl]-4-propyl-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4-propyl-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetyl]-4-propyl-1,4-benzoxazin-3-one Formula: C25H21N3O4S2 MolecularWeight: 491.58194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=C(C=C2)C(=O)CSC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

Isomeric SMILES

CCCN1C(=O)COC2=C1C=C(C=C2)C(=O)CSC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

InChI

InChI=1S/C25H21N3O4S2/c1-2-10-28-18-11-16(8-9-20(18)32-12-21(28)30)19(29)14-34-25-26-23(31)22-17(13-33-24(22)27-25)15-6-4-3-5-7-15/h3-9,11,13H,2,10,12,14H2,1H3,(H,26,27,31)