3-naphthalen-2-ylcarbonyl-5-oxidanylidene-1-phenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile

Systemtic Name: 3-naphthalen-2-ylcarbonyl-5-oxidanylidene-1-phenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Openeye Name: 3-(naphthalene-2-carbonyl)-5-oxo-1-phenyl-7-(2-thienyl)-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile CAS Name: 3-[2-naphthalenyl(oxo)methyl]-5-oxo-1-phenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile IUPAC Name: 3-(naphthalene-2-carbonyl)-5-oxo-1-phenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Traditional Name: 5-keto-3-(2-naphthoyl)-1-phenyl-7-(2-thienyl)-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Formula: C27H15N5O2S MolecularWeight: 473.5053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=C(C(=O)N3C(=N2)C(=O)C4=CC5=CC=CC=C5C=C4)C#N)C6=CC=CS6

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=C(C(=O)N3C(=N2)C(=O)C4=CC5=CC=CC=C5C=C4)C#N)C6=CC=CS6

InChI

InChI=1S/C27H15N5O2S/c28-16-21-23(22-11-6-14-35-22)29-27-31(26(21)34)25(30-32(27)20-9-2-1-3-10-20)24(33)19-13-12-17-7-4-5-8-18(17)15-19/h1-15H