N-[6-azanyl-2-(diphenylmethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-3,4-bis(fluoranyl)benzamide

Systemtic Name: N-[6-azanyl-2-(diphenylmethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-3,4-bis(fluoranyl)benzamide Openeye Name: N-(6-amino-2-benzhydrylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-3,4-difluoro-benzamide CAS Name: N-[6-amino-2-[(diphenylmethyl)thio]-4-oxo-1H-pyrimidin-5-yl]-3,4-difluorobenzamide IUPAC Name: N-(6-amino-2-benzhydrylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-3,4-difluorobenzamide Traditional Name: N-[6-amino-2-(benzhydrylthio)-4-keto-1H-pyrimidin-5-yl]-3,4-difluoro-benzamide Formula: C24H18F2N4O2S MolecularWeight: 464.487126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=NC(=O)C(=C(N3)N)NC(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=NC(=O)C(=C(N3)N)NC(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C24H18F2N4O2S/c25-17-12-11-16(13-18(17)26)22(31)28-19-21(27)29-24(30-23(19)32)33-20(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,20H,(H,28,31)(H3,27,29,30,32)