N-[6-azanyl-2-(diphenylmethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-methyl-benzamide

Systemtic Name: N-[6-azanyl-2-(diphenylmethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-methyl-benzamide Openeye Name: N-(6-amino-2-benzhydrylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-methyl-benzamide CAS Name: N-[6-amino-2-[(diphenylmethyl)thio]-4-oxo-1H-pyrimidin-5-yl]-4-methylbenzamide IUPAC Name: N-(6-amino-2-benzhydrylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-methylbenzamide Traditional Name: N-[6-amino-2-(benzhydrylthio)-4-keto-1H-pyrimidin-5-yl]-4-methyl-benzamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SC(C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SC(C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C25H22N4O2S/c1-16-12-14-19(15-13-16)23(30)27-20-22(26)28-25(29-24(20)31)32-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,21H,1H3,(H,27,30)(H3,26,28,29,31)