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

Systemtic Name: N-[6-azanyl-2-(diphenylmethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Openeye Name: N-(6-amino-2-benzhydrylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-ethoxy-benzamide CAS Name: N-[6-amino-2-[(diphenylmethyl)thio]-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide IUPAC Name: N-(6-amino-2-benzhydrylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-ethoxybenzamide Traditional Name: N-[6-amino-2-(benzhydrylthio)-4-keto-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SC(C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SC(C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C26H24N4O3S/c1-2-33-20-15-13-19(14-16-20)24(31)28-21-23(27)29-26(30-25(21)32)34-22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16,22H,2H2,1H3,(H,28,31)(H3,27,29,30,32)